data_2mc2_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 2mc2 _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 ' 13' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.958 0.408 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.79 126.09 30.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.42 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 10.5 mmm180 -112.83 156.59 22.63 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.096 0.475 . . . . 0.0 111.226 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 p -67.46 156.09 37.44 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.801 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 70.92 -2.84 2.18 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.856 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.42 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.1 m-20 -73.25 133.82 44.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.6 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -80.8 120.49 24.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.424 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -136.42 171.98 16.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.532 HG11 HD11 ' A' ' 62' ' ' LEU . 3.3 m -133.09 135.79 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 114.682 -1.145 . . . . 0.0 108.239 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -96.85 123.65 40.61 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.563 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 69.9 mt-30 -120.42 163.05 18.48 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.4 0.619 . . . . 0.0 111.359 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -150.96 139.43 20.48 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.422 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -83.81 121.41 27.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.513 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.4 ' HB1' HD13 ' A' ' 35' ' ' LEU . . . -114.67 119.09 35.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.968 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.4 m -122.91 136.9 55.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.002 0.43 . . . . 0.0 111.695 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.6 tt -171.49 145.32 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.3 m80 59.29 37.84 23.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.42 22.52 13.29 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.503 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.62 131.93 49.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.405 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -118.81 144.42 46.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.025 0.44 . . . . 0.0 111.41 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -154.03 171.93 18.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.631 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -119.41 141.14 49.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.429 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.471 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -130.23 141.97 50.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.469 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.8 p -106.38 138.19 43.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.022 0.439 . . . . 0.0 110.531 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.508 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.6 tp -60.02 110.46 1.2 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.187 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.458 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.83 165.15 11.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.518 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.92 167.14 9.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.801 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.02 150.62 44.64 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.537 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.11 -2.64 89.34 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.967 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -108.84 156.07 20.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 111.025 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.09 -141.6 23.41 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.276 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.443 HD21 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -81.07 7.88 9.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.753 0.311 . . . . 0.0 110.623 179.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.11 30.04 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.847 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.443 ' H ' HD21 ' A' ' 44' ' ' ASN . 41.8 mt -78.26 139.58 38.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.007 0.432 . . . . 0.0 110.415 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.5 m -80.15 150.5 30.17 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.545 0.688 . . . . 0.0 111.208 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -145.04 -168.6 2.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.658 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.508 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.8 mt -128.64 143.86 51.04 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.445 0.64 . . . . 0.0 112.031 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.505 -0.774 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.809 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.532 HD11 HG11 ' A' ' 21' ' ' VAL . 52.1 tp . . . . . 0 C--O 1.231 0.13 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t -55.67 -47.22 77.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.458 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.7 pt -68.78 -16.76 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 67.6 m -101.3 13.76 34.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.889 0.376 . . . . 0.0 110.826 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.5 m -91.56 130.18 37.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.717 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -136.78 159.94 40.34 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.097 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.524 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -124.09 132.03 71.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.654 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 23.5 mt -79.92 65.73 5.17 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.6 mm-40 -44.53 -64.53 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.419 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -122.81 165.35 16.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 112.963 -177.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.9 m -156.89 86.51 0.98 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.022 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.2 mt -114.22 158.23 21.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.472 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.8 t -70.24 148.19 48.86 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 177.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.41 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.6 t -51.33 -45.1 32.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -57.82 -52.77 64.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.093 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.7 -43.13 99.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.9 tp -61.47 -48.23 82.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.199 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 25.8 mt-30 . . . . . 0 C--N 1.324 -0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.696 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 9.9 tp10 . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 113.124 0.786 . . . . 0.0 113.124 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.696 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.1 pttm -80.74 -26.06 37.62 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.525 1.53 . . . . 0.0 112.698 -0.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -52.16 -57.46 9.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.583 ' H ' ' HG2' ' A' ' 96' ' ' GLU . 1.7 tmtp? -57.08 -52.39 65.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.347 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.416 ' HB2' ' H ' ' A' ' 96' ' ' GLU . 28.9 m-85 -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.871 0.367 . . . . 0.0 110.599 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 28.3 ttt -71.31 -40.41 70.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.802 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 24.1 ttt -68.35 -35.75 78.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.66 -44.64 70.11 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.479 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 29.2 p -65.93 -38.44 88.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.186 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -68.72 -44.86 72.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.734 179.901 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 . . . . . 0 CA--C 1.527 0.09 0 CA-C-O 121.123 0.487 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 87.8 m -74.03 146.27 43.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.212 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.96 133.77 35.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.701 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.5 mt -117.01 141.83 47.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.243 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -61.89 129.7 42.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.067 0.46 . . . . 0.0 110.463 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -12.09 58.05 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.117 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.44 140.75 32.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.096 0.474 . . . . 0.0 111.513 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.28 126.79 32.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.142 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 48.2 pt -111.97 159.54 11.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.471 0.653 . . . . 0.0 112.746 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.2 tp -114.51 108.8 17.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.889 -1.051 . . . . 0.0 109.895 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 67.0 mt -97.01 116.72 29.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.703 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.524 ' NH2' HG21 ' A' ' 68' ' ' VAL . 48.8 ttp85 -102.87 116.49 32.66 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.665 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.502 ' HD1' ' HB3' ' A' ' 126' ' ' SER . 26.2 t-80 -59.47 106.55 0.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 43.1 t -49.76 -47.38 50.97 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.454 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 57.5 t80 -64.26 -61.23 2.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.502 ' HB3' ' HD1' ' A' ' 123' ' ' HIS . 37.8 t -74.26 -16.83 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.43 -2.77 51.59 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.379 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.441 ' HE3' ' OG ' ' A' ' 126' ' ' SER . 54.2 mtt -83.46 -165.55 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.469 0.176 . . . . 0.0 110.626 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.471 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.7 m-85 -133.7 138.86 46.07 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.416 HD13 HD22 ' A' ' 37' ' ' LEU . 25.8 tp -55.65 125.54 21.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 17.7 p -136.26 147.71 47.67 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.4 t -93.15 98.6 11.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.518 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.7 mt -75.53 146.65 40.35 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.374 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -77.95 5.9 8.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.019 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.3 p -97.95 120.56 38.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 66.5 m . . . . . 0 C--N 1.322 -0.617 0 CA-C-O 120.918 0.389 . . . . 0.0 110.264 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.322 0.582 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 11.6 m-85 -100.91 173.32 6.54 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.043 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.51 145.13 24.69 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 93.3 t -114.33 116.1 51.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.174 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.54 -152.82 6.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.002 -1.094 . . . . 0.0 113.246 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 52.4 mt -113.22 143.44 44.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.823 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.462 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -129.37 141.13 51.14 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.831 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.85 -52.71 13.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.487 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.46 ' HB3' HG23 ' A' ' 154' ' ' THR . 7.5 m-20 -87.66 151.36 23.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.691 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 67.2 p -104.96 -6.34 20.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.823 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' THR . . . . . 0.46 HG23 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.37 115.59 2.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.467 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.14 -159.22 19.73 Favored Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.654 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.494 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -120.53 -13.9 8.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.719 0.295 . . . . 0.0 111.416 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.83 -33.35 66.68 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.6 m -88.62 6.22 39.28 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -110.02 133.75 52.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.146 0.498 . . . . 0.0 111.418 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 56.6 m95 -128.56 117.54 21.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.715 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 14.4 p -79.1 127.64 32.27 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.095 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.1 pt -89.64 134.83 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.986 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -128.61 151.72 77.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.262 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.647 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.1 Cg_endo -67.85 140.73 51.62 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.5 2.134 . . . . 0.0 112.515 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.83 -44.19 42.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 52.1 m -109.29 -173.64 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.132 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.558 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -90.46 6.15 44.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.147 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.558 HE22 ' HE2' ' A' ' 167' ' ' LYS . 10.5 mm-40 -80.58 -36.53 32.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.488 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.647 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 65.5 mmt-85 -90.0 148.16 23.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.229 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.4 m -127.99 166.8 17.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 111.382 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -66.64 133.81 51.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.235 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.96 -16.91 58.38 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.087 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -67.49 157.3 34.6 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.016 0.436 . . . . 0.0 111.313 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -74.36 140.53 44.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.238 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 88.0 t -90.23 119.84 38.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.371 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -83.61 154.85 23.53 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-O 121.283 0.564 . . . . 0.0 111.406 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 31.6 t -69.55 120.47 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.94 -7.81 35.95 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.376 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -71.45 129.33 38.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 110.853 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.535 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.2 m-20 -70.8 109.84 5.23 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 63.9 mt -97.14 149.67 21.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.759 0.79 . . . . 0.0 113.035 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 52.8 mt -114.46 112.94 42.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.83 136.7 33.01 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.161 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.418 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 74.1 t -128.73 123.13 58.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.735 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' SER . . . . . 0.577 ' HG ' ' HB3' ' A' ' 188' ' ' SER . 91.4 p -62.5 125.59 24.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.494 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 80.1 t -68.7 -32.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.166 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 89.5 p -77.52 -38.49 48.74 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.577 ' HB3' ' HG ' ' A' ' 185' ' ' SER . 41.2 t -115.59 2.95 13.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.38 27.17 3.51 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 20.9 mtt180 -107.79 142.5 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.974 0.416 . . . . 0.0 110.927 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.1 m-85 -73.74 154.9 39.41 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.421 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.0 tp -76.42 76.56 3.16 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -76.81 149.41 36.22 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 115.644 1.72 . . . . 0.0 115.644 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.439 ' H ' ' HG1' ' A' ' 210' ' ' THR . 14.7 tp -98.7 119.58 37.68 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.639 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.8 p -113.79 144.37 43.1 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -103.81 92.23 4.33 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.521 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -81.82 -176.86 51.44 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.321 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.521 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.3 m-20 4.28 -80.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.406 0.682 . . . . 0.0 112.449 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 37.5 t -145.24 8.2 1.2 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.019 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 57.3 m -122.39 -177.84 3.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -108.01 138.14 44.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.169 0.509 . . . . 0.0 111.129 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.435 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 28.3 m-70 -129.79 173.05 11.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.216 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.58 133.38 67.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.23 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.7 171.22 17.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.71 94.94 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.409 ' HB3' ' OD1' ' A' ' 204' ' ' ASP . . . -115.03 173.29 6.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.005 -178.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -82.41 10.56 6.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -116.43 137.64 52.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.523 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -67.12 174.91 2.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 122.297 1.046 . . . . 0.0 113.303 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.439 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 28.4 m -169.16 121.7 0.77 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 112.931 -1.94 . . . . 0.0 107.812 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.4 mt -74.74 130.58 39.73 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.018 0.437 . . . . 0.0 109.838 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -118.52 133.08 56.15 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.083 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 52.2 m -99.78 102.17 13.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.998 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.7 HG22 ' HG ' ' A' ' 22' ' ' LEU . 89.3 t -93.26 102.89 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.13 139.76 24.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.458 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.8 Cg_exo -63.8 105.82 0.58 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.134 1.889 . . . . 0.0 111.174 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.5 mm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.022 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 CA--C 1.518 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.15 121.91 26.7 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.48 157.2 19.2 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.104 0.478 . . . . 0.0 111.17 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -67.89 156.03 38.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.586 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 16' ' ' THR . 14.3 m-20 70.99 -3.29 2.06 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.89 -179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.9 m-20 -73.58 133.23 43.48 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -79.69 119.18 22.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.422 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -135.02 174.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.601 HG13 HD13 ' A' ' 62' ' ' LEU . 3.7 m -134.0 140.94 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.367 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.712 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -102.64 116.64 32.99 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.789 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.455 HE22 ' HE2' ' A' ' 34' ' ' LYS . 17.9 mt-30 -119.15 138.42 52.94 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.453 0.644 . . . . 0.0 112.259 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.541 ' HG ' HD12 ' A' ' 194' ' ' LEU . 26.0 p -123.06 143.8 49.72 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.648 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.7 m -84.35 123.18 29.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.391 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.418 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -114.59 122.04 45.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.338 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.1 m -125.01 136.21 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.62 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.3 tt -172.75 144.5 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.366 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.0 m80 58.59 37.5 25.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.918 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.76 26.21 15.5 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.327 179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -128.18 132.61 48.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.33 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -122.77 145.17 48.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.076 0.465 . . . . 0.0 111.396 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -156.39 178.62 10.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.783 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.455 ' HE2' HE22 ' A' ' 23' ' ' GLN . 32.7 mtmm -124.14 137.41 54.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.513 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.94 132.15 50.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.808 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.8 p -94.11 145.83 24.4 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.418 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 49' ' ' LEU . 34.2 tp -69.2 108.94 3.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.081 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.495 ' HB3' HD11 ' A' ' 64' ' ' ILE . . . -106.18 164.0 12.35 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.305 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.93 164.71 13.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.44 140.86 39.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.659 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.01 17.25 28.36 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.246 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -121.29 146.11 47.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.691 0.282 . . . . 0.0 110.469 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.12 -135.15 14.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.371 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.415 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.2 OUTLIER -84.02 9.16 13.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 110.996 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.477 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.06 33.63 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.222 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 25.4 mt -79.94 136.15 36.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.976 0.417 . . . . 0.0 110.652 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.9 m -76.9 151.28 35.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.539 0.685 . . . . 0.0 111.219 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -146.02 -170.74 3.55 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.736 -1.12 . . . . 0.0 108.538 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 37' ' ' LEU . 26.3 mt -126.41 145.75 50.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.483 0.659 . . . . 0.0 112.06 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.503 -0.855 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.601 HD13 HG13 ' A' ' 21' ' ' VAL . 48.9 tp . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.9 m -51.25 -44.43 61.73 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.495 HD11 ' HB3' ' A' ' 38' ' ' ALA . 28.8 pt -72.46 -20.83 19.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.4 m -98.94 13.18 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.75 0.31 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -89.25 129.56 35.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.133 0.492 . . . . 0.0 111.896 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -136.58 162.19 33.8 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.907 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.515 HG22 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.9 132.35 70.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.698 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.402 HD13 ' HB2' ' A' ' 18' ' ' ASP . 16.6 mt -80.47 66.7 6.07 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.479 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.3 mm-40 -46.75 -61.91 1.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -122.58 163.05 20.68 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.793 0.806 . . . . 0.0 112.899 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.6 t -156.1 83.33 1.0 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.819 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 mt -113.17 153.75 27.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.557 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.1 t -67.8 147.12 53.0 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 52.6 t -48.79 -44.64 15.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.106 0.479 . . . . 0.0 110.352 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -57.54 -53.7 55.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.225 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.63 -43.37 97.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.787 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.48 -46.68 89.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.349 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 49.8 mt-30 . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 120.807 0.337 . . . . 0.0 110.845 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.772 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 4.8 mm-40 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.772 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 34.2 mtmm -87.17 -51.14 6.16 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 125.059 1.344 . . . . 0.0 111.652 -2.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -58.99 -33.89 71.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.141 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.68 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 32.3 mtmm -62.86 -36.56 83.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.358 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.693 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 37.1 t80 -74.15 -48.0 32.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.885 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.7 ttt -58.31 -37.29 74.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.608 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 45.7 ttm -73.0 -43.86 61.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.827 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.28 -44.14 88.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.915 0.388 . . . . 0.0 110.744 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.2 p -71.29 -40.56 70.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.42 33.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.938 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.581 ' HA ' HE21 ' A' ' 106' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.89 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 121.072 0.463 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.0 m -78.71 148.2 33.16 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.124 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.19 132.47 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.672 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.2 mt -116.89 143.78 45.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.215 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -63.88 133.74 53.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.09 0.472 . . . . 0.0 110.469 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.89 -12.44 64.14 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.996 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.98 139.9 33.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.069 0.462 . . . . 0.0 111.509 -179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -82.13 126.51 32.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.7 pt -111.45 160.93 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.536 0.684 . . . . 0.0 112.773 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.1 tp -116.97 108.97 16.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.866 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.5 mt -96.44 117.72 31.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.613 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.515 ' NH2' HG22 ' A' ' 68' ' ' VAL . 46.8 ttp85 -103.25 116.77 33.09 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.758 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.469 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.1 t-80 -59.98 106.48 0.51 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 40.3 t -50.76 -44.99 58.68 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.469 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 49.2 t80 -64.85 -60.58 2.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.457 ' OG ' HD11 ' A' ' 149' ' ' LEU . 58.3 p -77.1 -14.53 59.79 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.26 -0.29 48.67 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.233 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -83.78 -165.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.469 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -134.42 140.33 46.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.408 HD11 HD23 ' A' ' 37' ' ' LEU . 25.9 tp -55.12 125.91 22.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.2 t -135.2 149.39 49.9 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.1 t -95.91 97.79 9.91 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.518 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.6 mt -74.18 151.26 40.04 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.681 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 76.2 p -80.79 6.06 14.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.866 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 77.5 p -93.66 123.03 36.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.0 110.986 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.806 179.824 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.485 0 CA-C-O 121.296 0.57 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.518 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.8 m-85 -99.41 169.82 9.06 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.218 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -89.23 140.74 29.18 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.712 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.0 t -110.39 117.66 55.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.57 -147.81 5.76 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.73 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 77.2 mt -117.93 148.6 42.02 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.935 0.397 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -141.67 139.38 32.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.803 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.1 -72.91 0.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.16 149.29 45.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 73.9 p -109.98 -2.8 16.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.2 p -54.84 116.81 2.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.69 -159.36 18.32 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.591 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.527 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.4 mt-10 -120.42 -10.06 9.35 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.809 0.338 . . . . 0.0 111.141 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.03 -31.95 67.5 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.8 m -93.93 9.52 37.1 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -110.49 131.48 55.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.094 0.473 . . . . 0.0 111.409 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.446 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.7 m95 -126.7 116.43 20.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.579 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 9.6 p -78.93 127.39 31.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.24 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . 0.411 HD11 HG23 ' A' ' 175' ' ' VAL . 3.6 pt -88.72 135.21 26.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -128.22 150.17 73.28 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.158 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.651 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.6 Cg_endo -67.36 139.85 51.01 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.668 2.245 . . . . 0.0 112.153 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.25 -44.93 58.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.697 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.411 ' HB3' HE21 ' A' ' 168' ' ' GLN . 51.0 m -110.98 -171.83 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.249 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.531 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -91.88 11.26 25.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.227 -179.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.531 HE22 ' HE2' ' A' ' 167' ' ' LYS . 7.3 mm-40 -84.74 -34.59 22.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.112 0.482 . . . . 0.0 110.437 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.651 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.5 mmp_? -92.57 147.21 23.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.14 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 31.3 t -126.52 166.46 17.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.826 0.346 . . . . 0.0 111.298 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.56 131.66 46.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.463 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.87 -14.13 65.9 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.146 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.6 mt-10 -70.51 154.86 41.43 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 111.134 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -70.75 143.75 51.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.411 HG23 HD11 ' A' ' 162' ' ' ILE . 98.2 t -94.02 110.86 24.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.432 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -73.71 153.04 40.23 Favored 'General case' 0 CA--C 1.5 -0.974 0 CA-C-O 121.308 0.575 . . . . 0.0 111.409 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 38.7 t -68.69 121.4 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 176.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.4 -15.26 32.69 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.172 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.05 127.58 32.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 120.833 0.349 . . . . 0.0 110.9 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.461 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -68.92 112.25 5.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.409 HD21 HG13 ' A' ' 175' ' ' VAL . 65.3 mt -98.77 149.02 23.3 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.836 0.827 . . . . 0.0 113.166 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.468 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.8 mt -114.57 112.97 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.97 138.98 31.0 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.1 0.476 . . . . 0.0 111.988 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.426 HG23 ' CD1' ' A' ' 191' ' ' TYR . 69.9 t -130.77 123.27 54.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.0 t -63.04 122.09 15.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.527 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 79.2 t -65.44 -34.46 70.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 120.806 0.336 . . . . 0.0 111.253 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.9 p -78.03 -39.65 41.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.494 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 49.2 m -113.22 9.63 18.44 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 188' ' ' SER . 0.0 OUTLIER 43.56 30.7 0.37 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.718 0.636 . . . . 0.0 112.587 179.257 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.489 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 32.5 mtt85 -111.79 141.4 45.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.939 -179.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.484 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 61.3 m-85 -73.0 153.41 40.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.8 tp -75.61 75.65 2.62 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 175.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -75.2 151.63 38.45 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.541 HD12 ' HG ' ' A' ' 24' ' ' CYS . 12.9 tp -101.43 119.44 38.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.559 176.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 35.5 p -113.51 146.73 39.17 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.09 89.61 3.12 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.23 -174.75 43.88 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.214 -0.994 . . . . 0.0 111.515 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.6 m-80 1.11 -78.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.421 0.688 . . . . 0.0 112.417 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 48.9 m -147.09 10.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.099 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.6 p -125.37 -178.85 4.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.941 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.418 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.0 m95 -107.49 135.3 49.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.273 0.559 . . . . 0.0 111.175 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.455 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 25.0 m-70 -126.95 172.72 10.21 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.23 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.32 132.8 70.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.121 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.408 ' OD1' ' HB1' ' A' ' 206' ' ' ALA . 2.8 p30 -150.74 170.52 19.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.549 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.484 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.38 96.34 8.3 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.408 ' HB1' ' OD1' ' A' ' 204' ' ' ASP . . . -114.38 -179.46 3.64 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.403 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.6 8.36 28.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.283 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.21 137.28 52.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.569 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.468 ' NE2' HD13 ' A' ' 182' ' ' ILE . 94.4 mt-30 -64.63 174.51 1.75 Allowed 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 122.295 1.045 . . . . 0.0 112.949 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.3 m -166.58 121.16 1.11 Allowed 'General case' 0 N--CA 1.44 -0.975 0 CA-C-N 113.13 -1.85 . . . . 0.0 107.994 178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.3 mt -74.99 128.94 36.76 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.055 0.455 . . . . 0.0 109.89 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.415 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.9 m95 -116.53 147.83 41.42 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.456 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 53.1 m -114.86 99.77 7.73 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.462 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.712 HG22 ' HG ' ' A' ' 22' ' ' LEU . 74.0 t -92.09 101.12 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.842 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.58 142.31 28.68 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.056 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.436 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.42 104.32 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.2 1.933 . . . . 0.0 110.995 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.446 HD13 ' HA ' ' A' ' 217' ' ' ILE . 1.9 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.211 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.25 123.35 27.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.463 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 10.5 mmm180 -111.56 156.38 21.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.162 0.505 . . . . 0.0 111.396 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.6 p -67.35 156.62 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.611 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 16' ' ' THR . 8.5 m-20 71.39 -5.05 1.68 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.8 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.2 m-20 -72.68 133.84 44.8 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.684 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.64 121.74 26.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.24 172.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -177.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.555 HG12 HD11 ' A' ' 62' ' ' LEU . 3.5 m -133.32 136.28 55.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.545 -1.207 . . . . 0.0 108.222 176.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.69 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.74 121.96 40.27 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.557 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.452 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.2 mt-30 -118.96 161.31 20.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.375 0.607 . . . . 0.0 111.425 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.94 140.82 24.79 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.497 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.3 m -84.21 120.34 26.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.419 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.61 120.79 42.14 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.01 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.9 m -125.4 129.66 50.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.599 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.408 HG21 ' CD2' ' A' ' 29' ' ' HIS . 15.7 tt -165.21 146.28 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.624 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.408 ' CD2' HG21 ' A' ' 28' ' ' ILE . 43.6 m-70 58.47 44.44 18.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.225 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.41 ' N ' ' HE3' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 60.27 22.23 11.66 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.854 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -127.62 147.5 50.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.482 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -132.75 148.5 52.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.957 0.408 . . . . 0.0 111.179 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -159.47 173.11 16.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -120.66 137.06 54.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.447 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 23' ' ' GLN . 1.9 mt -126.24 141.72 51.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.9 p -104.73 141.83 35.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.022 0.439 . . . . 0.0 110.387 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.3 tp -64.31 109.26 1.84 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.121 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 64' ' ' ILE . . . -107.11 162.69 13.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.545 -179.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.48 164.52 14.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.65 143.21 35.02 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.679 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.84 12.36 42.53 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.267 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -116.72 150.15 38.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.662 0.268 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.88 -138.34 19.27 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.317 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.6 p30 -84.69 11.93 8.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.661 0.267 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.96 29.55 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.269 179.537 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.65 140.85 38.34 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 120.975 0.417 . . . . 0.0 110.626 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.46 152.56 26.05 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.557 0.694 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -146.49 -169.19 3.21 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.581 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -128.06 143.8 51.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.423 0.63 . . . . 0.0 111.964 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.502 -0.87 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.651 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.555 HD11 HG12 ' A' ' 21' ' ' VAL . 42.9 tp . . . . . 0 C--O 1.232 0.134 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.9 p -53.64 -42.71 68.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 38' ' ' ALA . 27.3 pt -72.18 -17.72 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.5 m -101.92 14.27 32.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.651 0.262 . . . . 0.0 111.226 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.1 m -90.67 128.94 36.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.079 0.466 . . . . 0.0 111.719 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -136.35 159.38 41.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.984 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.504 HG22 ' NH2' ' A' ' 122' ' ' ARG . 3.2 t -123.23 132.56 71.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.716 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 mt -80.06 65.87 5.36 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.466 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 11.2 mm-40 -45.24 -67.09 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.415 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 18.6 mm-40 -118.99 164.48 15.41 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.687 0.756 . . . . 0.0 112.82 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.1 t -157.21 82.59 0.92 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.864 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.62 157.37 19.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.419 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.0 t -69.68 146.82 51.29 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.6 t -49.38 -46.06 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 16.8 ttp-105 -55.24 -58.53 7.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.097 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.54 75.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.923 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.3 tp -58.78 -49.32 78.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.243 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 94.7 mt-30 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.763 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.0 mm-40 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.34 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.763 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.1 mttt -88.41 -51.37 5.77 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 125.005 1.322 . . . . 0.0 111.225 -3.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -63.2 -28.36 69.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.724 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 23.9 tptm -63.31 -40.76 98.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.119 -0.633 . . . . 0.0 109.912 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.575 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.4 t80 -74.26 -44.12 54.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.949 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.58 -41.28 76.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.391 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.4 tpt -74.97 -41.15 60.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.992 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.562 ' HB2' ' HZ2' ' A' ' 103' ' ' LYS . 4.0 ttmp? -57.82 -42.82 85.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.942 0.401 . . . . 0.0 110.552 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 77.0 m -72.06 -48.56 43.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.747 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.1 64.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.8 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.196 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 121.077 0.465 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.463 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 85.6 m -76.25 147.18 38.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.906 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.33 131.12 35.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.756 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.0 mt -115.26 140.9 48.71 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.22 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.568 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 37.8 m-85 -61.45 130.04 44.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.008 0.432 . . . . 0.0 110.341 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.35 -13.06 58.54 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.13 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.51 141.28 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.042 0.449 . . . . 0.0 111.359 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.67 128.29 34.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.097 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 160' ' ' TRP . 41.5 pt -113.39 159.53 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.579 0.704 . . . . 0.0 112.818 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.415 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.5 tp -116.09 110.5 18.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.889 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 mt -97.98 118.01 33.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.469 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.504 ' NH2' HG22 ' A' ' 68' ' ' VAL . 54.4 ttp85 -103.0 116.39 32.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.73 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.3 t-80 -59.29 105.67 0.36 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 177.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 46.9 t -50.28 -45.56 54.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.51 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.5 t80 -64.2 -61.85 1.99 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.459 ' HG ' ' H ' ' A' ' 128' ' ' MET . 53.4 p -76.62 -13.75 60.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 72.82 1.34 54.49 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.172 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.459 ' H ' ' HG ' ' A' ' 126' ' ' SER . 53.9 mtt -84.04 -164.98 1.02 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.466 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 68.9 m-85 -135.42 138.67 43.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.75 126.2 23.11 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 42.1 t -134.69 148.27 50.28 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.6 t -95.21 96.57 9.28 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.525 -1.216 . . . . 0.0 107.758 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.522 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.5 mt -73.96 152.03 40.2 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 89.9 p -83.66 6.41 20.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.083 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.3 p -95.4 121.6 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.724 0.297 . . . . 0.0 111.025 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.772 179.829 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.465 0 CA-C-O 121.401 0.62 . . . . 0.0 112.321 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.2 m-85 -101.73 170.54 8.1 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.887 -1.051 . . . . 0.0 108.98 178.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.35 142.47 27.7 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 67.7 t -112.71 117.22 54.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.344 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.06 -146.89 5.54 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.844 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 73.1 mt -117.92 152.61 35.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.838 0.352 . . . . 0.0 110.531 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -142.32 140.1 32.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.66 -46.37 46.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.463 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -87.17 143.3 27.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 72.2 p -105.83 -8.54 17.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -53.23 114.44 1.47 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.513 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.91 -155.39 20.19 Favored Glycine 0 N--CA 1.441 -1.028 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.614 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.478 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -123.04 -13.94 7.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.704 0.288 . . . . 0.0 111.362 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.53 -32.99 67.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 74.3 m -90.47 8.14 35.33 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -111.55 132.26 54.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.055 0.455 . . . . 0.0 111.486 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.416 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.9 m95 -126.75 118.41 24.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.661 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -80.08 126.59 31.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.98 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.2 pt -88.19 135.8 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -128.77 150.72 75.72 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.253 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.621 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.16 138.87 53.33 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.585 2.19 . . . . 0.0 112.349 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.19 -40.29 45.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.557 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 96.0 p -109.05 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.6 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.76 5.05 53.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.655 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -85.48 -29.56 24.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.041 0.448 . . . . 0.0 110.866 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.621 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 73.9 mmt-85 -92.11 146.71 23.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.374 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 45.1 t -129.52 167.55 17.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.322 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.24 136.19 56.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.376 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.48 -15.91 55.15 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.459 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 170' ' ' SER . 30.8 mt-10 -68.36 155.48 39.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.026 0.441 . . . . 0.0 111.254 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -73.38 141.47 47.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.43 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 98.1 t -91.07 123.1 43.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.375 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -87.69 154.67 20.4 Favored 'General case' 0 CA--C 1.496 -1.126 0 CA-C-O 121.266 0.555 . . . . 0.0 111.405 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.76 120.95 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.62 -11.63 30.3 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.907 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -72.21 126.73 30.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.75 0.309 . . . . 0.0 110.779 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.4 m-20 -69.49 115.5 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 73.9 mt -100.31 148.26 24.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.763 0.792 . . . . 0.0 112.961 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.44 HD12 ' NE2' ' A' ' 209' ' ' GLN . 57.6 mt -113.49 112.75 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 176.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.4 mp -93.16 139.45 30.58 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.073 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.421 HG23 ' CD1' ' A' ' 191' ' ' TYR . 71.4 t -130.8 127.8 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.718 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 4.3 m -65.05 124.95 23.44 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.478 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 94.2 t -69.1 -32.07 52.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.716 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.88 -36.2 36.9 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 61.3 m -116.64 4.9 13.17 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -177.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.15 31.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.466 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 30.0 mtt85 -112.25 141.69 45.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.2 m-85 -72.88 152.92 41.24 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.5 tp -75.11 76.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -76.88 150.12 36.04 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.1 tp -99.87 119.09 37.66 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.627 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 55.6 p -113.48 147.7 37.36 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -107.0 90.8 3.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -174.49 45.7 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.411 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 18.0 m120 0.6 -78.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.397 0.679 . . . . 0.0 112.449 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 57.4 m -147.68 12.85 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.126 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 54.6 m -126.9 -178.14 4.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -107.88 134.44 50.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.175 0.512 . . . . 0.0 111.158 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.457 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 27.6 m-70 -126.46 172.46 10.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.1 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.93 131.59 70.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.237 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 206' ' ' ALA . 2.9 p30 -148.73 172.09 15.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.655 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.25 95.54 7.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.022 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.415 ' HB2' ' OD1' ' A' ' 204' ' ' ASP . . . -113.9 -179.03 3.52 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.299 -177.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -88.61 7.94 30.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.17 138.33 51.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.584 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.44 ' NE2' HD12 ' A' ' 182' ' ' ILE . 96.4 mt-30 -68.37 173.41 4.9 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.274 1.035 . . . . 0.0 112.828 -178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -164.79 120.4 1.43 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 113.121 -1.854 . . . . 0.0 107.843 178.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.5 mt -73.89 127.52 33.06 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.47 -0.492 . . . . 0.0 109.943 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.412 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.76 140.92 48.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.731 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.2 t -107.9 100.45 9.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.55 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.69 HG22 ' HG ' ' A' ' 22' ' ' LEU . 65.0 t -92.16 102.93 14.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.781 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.27 142.09 28.13 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.349 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.433 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.2 Cg_exo -63.54 103.99 0.42 Allowed 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.218 1.946 . . . . 0.0 111.165 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.449 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.0 mm . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.295 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.403 ' HB3' HG23 ' A' ' 112' ' ' THR . 68.6 m-85 . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 120.655 0.264 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.1 mt -76.91 120.61 22.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.411 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.7 mmm180 -109.87 156.19 20.71 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.066 0.46 . . . . 0.0 111.217 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.42 ' C ' ' H ' ' A' ' 18' ' ' ASP . 11.0 p -67.1 157.68 33.01 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 70.53 -4.71 1.57 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 16' ' ' THR . 4.6 m-20 -72.28 133.01 44.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.75 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -79.53 119.84 23.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.477 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.1 m -137.06 172.41 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.666 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 5.4 m -132.71 137.55 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.368 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.68 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.7 mp -97.8 120.66 38.59 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.854 -0.339 . . . . 0.0 110.535 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -119.0 159.68 23.41 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.416 0.627 . . . . 0.0 111.521 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.9 p -146.24 140.76 26.78 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.563 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -83.35 124.09 30.29 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.405 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.443 ' HB1' HD13 ' A' ' 35' ' ' LEU . . . -116.18 118.5 32.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.914 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.9 m -122.4 136.56 54.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.736 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 tt -176.0 143.84 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.781 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.3 m80 58.03 42.51 22.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.391 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 60.03 22.02 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.426 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -127.19 129.67 48.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.704 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -121.72 144.45 48.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.022 0.439 . . . . 0.0 111.18 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -155.37 175.58 13.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.806 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.9 mtmm -122.36 136.63 54.93 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.561 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.443 HD13 ' HB1' ' A' ' 26' ' ' ALA . 1.5 mt -126.51 141.28 51.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.64 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.579 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.7 t -105.08 144.8 31.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.976 0.417 . . . . 0.0 110.633 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.441 ' HA ' HD21 ' A' ' 49' ' ' LEU . 34.7 tp -64.01 115.34 4.82 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.817 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.418 ' HB1' HD13 ' A' ' 64' ' ' ILE . . . -114.0 163.83 14.62 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.56 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.04 166.83 10.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.753 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.3 144.46 32.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.439 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.63 14.94 38.76 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.288 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -117.64 146.76 43.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.8 0.333 . . . . 0.0 110.693 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -135.24 14.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.538 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -84.3 9.33 13.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.629 0.252 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.59 30.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.177 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.68 139.54 38.49 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.093 0.473 . . . . 0.0 110.712 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.5 m -80.67 152.62 28.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -146.96 -163.91 1.87 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.436 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 37' ' ' LEU . 23.0 mt -131.28 140.71 49.84 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 112.203 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 . . . . . 0 CA--C 1.504 -0.82 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.673 179.598 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.568 HD12 HG12 ' A' ' 21' ' ' VAL . 42.0 tp . . . . . 0 N--CA 1.458 -0.059 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.1 p -48.83 -52.65 23.02 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.418 HD13 ' HB1' ' A' ' 38' ' ' ALA . 31.0 pt -69.94 -15.14 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.666 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.95 -1.87 38.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.2 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 134.01 34.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 0.0 112.199 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -138.2 161.38 37.0 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.952 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.484 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.5 t -125.82 132.12 71.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.727 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.83 64.5 5.63 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.472 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 14.2 mm-40 -43.3 -62.83 0.94 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -178.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -124.74 164.33 20.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.744 0.783 . . . . 0.0 112.716 -177.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.3 t -156.29 84.08 0.99 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.387 -1.279 . . . . 0.0 108.888 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -112.99 154.94 25.67 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.397 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 81.9 p -67.68 150.21 49.01 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.465 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 43.2 t -52.69 -41.94 39.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.055 0.455 . . . . 0.0 110.274 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.9 ttp85 -59.98 -51.44 69.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.13 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.65 91.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.745 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.5 tp -64.18 -44.17 92.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.862 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 44.8 mt-30 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 120.964 0.411 . . . . 0.0 110.469 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.77 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.77 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.5 mttt -88.18 -52.02 5.46 Favored 'General case' 0 C--N 1.352 0.684 0 CA-C-N 120.431 1.469 . . . . 0.0 111.529 -3.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -65.85 -28.76 69.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.033 -1.44 . . . . 0.0 113.071 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 75.7 mmtt -59.51 -48.96 79.62 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.139 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.595 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 74.3 t80 -73.96 -39.53 63.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.564 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.5 ttm -59.87 -38.09 81.2 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.573 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.17 -46.93 30.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.675 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -58.01 -43.83 86.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 62.9 m -72.07 -45.72 59.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.49 -56.56 18.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.288 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.265 -179.842 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 121.138 0.494 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.408 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 88.8 m -71.28 146.36 48.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.348 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.39 133.31 35.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.419 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.56 142.31 47.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.994 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.547 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.6 m-85 -63.25 124.45 21.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.132 0.491 . . . . 0.0 110.484 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.94 -13.64 41.21 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.887 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.48 141.31 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.993 0.425 . . . . 0.0 111.328 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.25 128.45 34.2 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.3 pt -113.01 159.36 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.579 0.704 . . . . 0.0 112.833 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.1 tp -115.42 109.29 17.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.834 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -97.5 116.86 30.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.696 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.484 ' NH2' HG21 ' A' ' 68' ' ' VAL . 61.8 ttp85 -102.67 116.51 32.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.706 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.461 ' HD1' ' CB ' ' A' ' 126' ' ' SER . 19.5 t-80 -59.88 106.78 0.53 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 41.5 m -52.06 -43.45 63.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 56.4 t80 -66.0 -58.67 5.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.461 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 20.0 m -79.12 -13.3 59.82 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . 0.422 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 72.18 -0.85 37.13 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.307 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.2 mtt -83.24 -165.47 1.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.472 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -133.94 139.0 45.84 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 23.5 tp -55.77 124.95 19.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.1 t -133.36 148.08 51.84 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -176.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -94.19 98.76 11.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.513 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.1 mt -76.91 147.34 37.06 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.578 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -78.89 6.22 9.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.911 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.9 p -92.2 124.1 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.879 -179.841 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.666 0 CA-C-O 121.048 0.451 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.7 m-85 -99.87 171.09 8.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.272 178.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -90.17 143.59 26.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.031 0.443 . . . . 0.0 109.935 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.21 116.0 51.38 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.311 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.64 -151.75 6.61 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.91 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 46.3 mt -113.51 149.14 34.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -140.38 140.06 35.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.69 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -74.17 -49.4 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.551 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.01 143.85 30.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.834 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.5 p -106.47 -7.81 17.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.707 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.3 p -52.88 114.96 1.6 Allowed 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.636 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.75 -157.04 19.67 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.712 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.49 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -120.16 -13.9 8.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.759 0.314 . . . . 0.0 111.338 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 68.4 m -90.63 8.05 36.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -110.84 132.58 54.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.042 0.449 . . . . 0.0 111.241 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.427 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.4 m95 -127.03 116.23 20.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.721 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.3 p -78.3 125.18 28.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.7 pt -86.92 136.66 22.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.844 0.354 . . . . 0.0 110.918 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.5 m80 -128.58 149.04 70.76 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.095 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.59 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 33.9 Cg_endo -65.31 137.07 49.93 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.455 2.103 . . . . 0.0 112.511 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -78.22 -40.1 38.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.426 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 78.4 p -105.95 -171.21 1.86 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.406 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -95.03 -7.25 40.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.408 ' NE2' ' N ' ' A' ' 168' ' ' GLN . 1.7 mp0 -72.99 -32.39 65.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.022 0.439 . . . . 0.0 110.883 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.59 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.2 mmp_? -90.25 146.66 24.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.499 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.2 m -130.15 167.22 18.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.126 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -66.77 128.79 37.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.337 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 96.11 -13.55 65.76 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -70.55 156.39 39.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.045 0.45 . . . . 0.0 111.283 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -73.91 139.67 45.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.456 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.1 t -89.7 119.53 36.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.213 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 153.71 23.93 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 121.246 0.546 . . . . 0.0 111.516 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 13.6 t -68.6 118.31 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.67 -8.01 29.97 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.276 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.14 136.34 44.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.79 0.329 . . . . 0.0 110.802 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.516 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 38.6 m-20 -76.98 114.2 15.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.457 HD13 HG22 ' A' ' 214' ' ' VAL . 64.4 mt -99.64 149.25 23.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.755 0.788 . . . . 0.0 112.955 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.469 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 66.3 mt -114.62 112.17 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 176.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -91.8 139.44 30.67 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.089 0.471 . . . . 0.0 112.156 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.431 HG21 ' CD1' ' A' ' 191' ' ' TYR . 72.7 t -131.88 121.74 47.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.902 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 95.6 p -61.42 120.27 10.15 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.49 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 91.7 t -63.38 -34.03 64.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.319 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.6 p -77.73 -39.33 44.84 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.432 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.7 m -113.71 7.39 17.18 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.39 31.29 1.24 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.446 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 22.1 mtt180 -112.7 140.65 47.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.96 0.409 . . . . 0.0 110.812 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 50.8 m-85 -72.91 152.97 41.2 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 37.4 tp -74.92 77.56 2.16 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 175.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -77.5 150.61 34.84 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -174.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.409 HD13 ' CE3' ' A' ' 201' ' ' TRP . 12.0 tp -100.43 117.81 35.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.589 176.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 43.0 t -111.32 145.7 38.36 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.45 90.17 3.33 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.524 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.37 -175.55 45.49 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.432 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' A' ' 197' ' ' GLY . 9.9 m120 1.16 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.449 0.7 . . . . 0.0 112.459 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 77.3 p -146.13 10.62 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.153 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 67.3 p -125.23 -177.88 4.02 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.992 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 91.6 m95 -108.23 137.3 46.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 111.206 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.462 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 26.4 m-70 -129.22 172.47 11.42 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.027 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.54 134.7 65.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.246 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -153.06 170.93 19.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.509 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.06 94.47 6.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -112.82 178.18 4.38 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.402 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -86.41 10.97 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -119.5 136.83 54.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -65.07 176.3 1.31 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 122.399 1.095 . . . . 0.0 113.143 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.5 m -169.28 120.43 0.72 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 112.946 -1.933 . . . . 0.0 107.729 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 22.4 mt -74.6 127.58 33.44 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.041 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.419 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.7 m95 -114.34 141.82 47.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.733 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.3 t -108.87 100.44 9.65 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.524 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.68 HG21 ' HG ' ' A' ' 22' ' ' LEU . 86.8 t -91.82 102.13 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.682 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.87 141.96 27.65 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.233 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.412 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.76 104.46 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.033 1.822 . . . . 0.0 111.316 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.477 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.202 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 . . . . . 0 CA--C 1.519 -0.249 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 34.4 mt -79.58 122.32 26.35 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.8 mmm180 -110.17 157.3 19.54 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.018 0.437 . . . . 0.0 111.272 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.42 ' HG1' ' H ' ' A' ' 111' ' ' ARG . 7.6 p -67.79 155.22 39.82 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.889 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.66 -7.89 1.49 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.624 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.1 m-20 -69.15 137.94 53.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.767 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -84.39 119.38 25.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.0 m -136.15 170.03 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.686 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.4 m -132.14 139.65 49.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.414 176.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.67 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.7 mp -100.58 119.72 38.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.7 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 43.6 mt-30 -117.6 163.34 16.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 121.298 0.57 . . . . 0.0 111.374 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.25 144.24 25.46 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.2 m -87.41 123.29 32.2 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.621 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -115.04 121.18 42.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.885 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.5 m -124.73 132.91 53.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.714 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.3 tt -172.0 148.88 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.644 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.3 m80 58.75 41.44 21.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.43 21.93 11.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.39 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -126.34 150.12 48.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.534 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -135.38 146.47 48.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.91 0.386 . . . . 0.0 110.839 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.558 ' NE2' HD21 ' A' ' 35' ' ' LEU . 9.1 pt20 -158.37 172.01 19.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.763 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -118.7 137.09 53.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.534 178.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.558 HD21 ' NE2' ' A' ' 33' ' ' GLN . 2.2 mt -127.37 140.75 51.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.746 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 53.6 t -104.47 146.97 28.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.926 0.393 . . . . 0.0 110.259 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HA ' HD22 ' A' ' 49' ' ' LEU . 32.9 tp -66.57 112.23 4.03 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.799 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.32 163.72 13.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.436 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.01 162.72 15.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.912 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.71 144.02 45.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.68 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.55 18.81 31.76 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.167 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -124.33 146.57 48.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.841 0.353 . . . . 0.0 110.607 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.15 -137.65 18.78 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.434 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -80.89 7.76 9.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.655 0.264 . . . . 0.0 110.922 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.445 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.18 32.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.046 179.669 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.1 mt -78.72 135.43 37.15 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.982 0.42 . . . . 0.0 110.693 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -75.57 150.35 38.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.569 0.699 . . . . 0.0 111.33 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -144.39 -165.84 2.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.502 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' A' ' 37' ' ' LEU . 35.0 mt -129.99 143.6 50.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.395 0.617 . . . . 0.0 112.238 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.504 -0.813 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.674 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.575 HD13 HG12 ' A' ' 21' ' ' VAL . 46.4 tp . . . . . 0 CA--C 1.526 0.034 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.9 m -48.43 -49.64 34.38 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.446 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.7 pt -72.67 -16.92 18.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.856 -179.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.686 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -99.09 -1.07 40.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.409 -178.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.3 m -86.18 132.2 34.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 112.187 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -136.41 161.51 35.62 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.043 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.477 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.41 133.66 68.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.751 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 HG12 ' A' ' 20' ' ' VAL . 17.9 mt -82.34 65.59 7.55 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 14.4 mm-40 -44.42 -63.91 0.79 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.401 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.4 mm100 -123.78 164.74 18.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.69 0.757 . . . . 0.0 112.742 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.21 86.98 1.03 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.068 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.2 mt -113.73 156.08 24.44 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.138 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.8 t -69.19 149.35 48.69 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.465 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 49.6 t -51.34 -44.4 31.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.074 0.464 . . . . 0.0 110.361 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.4 ttp-105 -56.99 -57.04 14.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.985 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.14 -43.17 87.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.633 -179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.36 -48.02 83.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.076 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 44.8 mt-30 . . . . . 0 C--N 1.323 -0.578 0 CA-C-O 121.007 0.432 . . . . 0.0 110.584 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.694 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 25.1 mm-40 . . . . . 0 CA--C 1.534 0.355 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.723 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.694 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 16.6 ptpt -86.66 -49.63 7.37 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.21 1.404 . . . . 0.0 111.304 -3.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -54.19 -41.48 68.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.854 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.6 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 66.1 tttp -59.56 -31.07 69.08 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.95 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.676 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.1 t80 -73.3 -44.94 58.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.43 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 68.1 mmm -56.79 -46.96 81.21 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.07 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 57.2 ttp -68.84 -42.82 76.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.336 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -57.68 -45.8 85.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.849 0.356 . . . . 0.0 110.856 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 36.5 m -68.54 -43.54 76.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.846 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.59 72.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.859 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.83 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.42 ' H ' ' HG1' ' A' ' 16' ' ' THR . 11.7 ptp180 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 121.095 0.474 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.437 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 80.9 m -74.25 147.18 42.65 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.53 130.48 35.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -114.95 141.66 47.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.159 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.94 125.4 23.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 105.17 -12.28 48.49 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.121 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.41 142.29 32.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.081 0.467 . . . . 0.0 111.237 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.92 126.41 32.45 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.5 pt -112.19 159.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.401 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 19.1 tp -114.38 109.24 18.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.877 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.3 mt -97.11 116.22 28.92 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.779 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.477 ' NH2' HG21 ' A' ' 68' ' ' VAL . 58.7 ttp85 -101.86 116.5 32.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.715 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.459 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.4 t-80 -59.8 106.22 0.46 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 62.0 m -49.18 -46.5 45.6 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.459 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 63.3 t80 -64.06 -64.26 0.94 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.458 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 14.7 m -72.69 -14.79 61.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.1 -1.45 40.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.179 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 49.3 mtt -82.01 -165.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.525 0.203 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.478 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 66.6 m-85 -134.6 138.69 44.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.1 tp -54.99 126.14 23.34 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.4 t -134.71 147.77 50.15 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . 0.524 ' HG ' ' HB2' ' A' ' 188' ' ' SER . 53.0 t -95.48 98.12 10.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.0 mt -75.02 149.54 39.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -80.84 5.96 14.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.783 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.8 p -90.32 122.83 33.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.737 0.303 . . . . 0.0 111.074 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.8 179.845 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.242 0.544 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.531 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -100.83 170.79 8.08 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.166 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -89.43 143.76 26.57 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 120.995 0.426 . . . . 0.0 109.949 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.4 t -113.49 118.0 56.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.312 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.48 -148.43 5.51 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.98 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 52.2 mt -115.92 151.29 35.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.077 0.465 . . . . 0.0 110.831 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -141.15 139.94 34.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.579 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -73.35 -52.87 12.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -82.57 147.05 28.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 58.2 p -105.49 -5.03 20.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -55.74 113.08 1.33 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.453 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.47 -159.61 21.45 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.593 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.449 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 36.5 mt-10 -118.79 -13.26 9.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.808 0.337 . . . . 0.0 111.428 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.94 -32.88 66.44 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 64.9 m -91.17 7.19 41.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.19 133.98 52.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.016 0.436 . . . . 0.0 111.253 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.414 ' O ' HG12 ' A' ' 119' ' ' ILE . 57.3 m95 -128.8 117.72 21.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.822 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.424 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 13.6 p -79.08 125.65 29.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.112 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.3 pt -88.01 136.11 23.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.94 0.4 . . . . 0.0 110.943 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -128.76 151.41 77.15 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.305 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.646 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.1 Cg_endo -67.51 140.93 53.81 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.598 2.199 . . . . 0.0 112.274 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -44.52 53.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.847 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -110.8 -170.85 1.72 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.248 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.519 ' HE3' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -92.44 9.26 35.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.149 -179.819 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.519 HE22 ' HE3' ' A' ' 167' ' ' LYS . 9.9 mm-40 -83.03 -35.25 25.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.548 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.646 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 77.3 mmt-85 -91.96 146.56 23.64 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.299 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 46.1 t -123.95 165.52 17.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.398 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.18 129.46 40.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.23 -13.53 64.54 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.851 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.49 156.09 39.83 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 37.6 mttp -72.81 140.51 47.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -90.25 120.06 38.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.534 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -83.85 155.64 22.83 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 121.344 0.593 . . . . 0.0 111.533 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 25.0 t -71.13 120.33 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.08 -11.69 31.67 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.167 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -70.67 129.82 40.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.742 0.306 . . . . 0.0 110.907 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.558 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.5 m-20 -71.41 114.81 9.87 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.534 HD13 HG22 ' A' ' 214' ' ' VAL . 69.2 mt -100.43 148.11 25.11 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 50.7 mt -113.64 113.39 43.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 176.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -93.12 137.1 32.77 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.167 0.508 . . . . 0.0 112.107 -178.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.424 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 78.7 t -129.14 121.1 53.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' SER . . . . . 0.456 ' HG ' ' HB2' ' A' ' 188' ' ' SER . 86.5 p -61.31 124.19 19.9 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.449 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.6 t -67.81 -32.25 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.172 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 98.2 p -77.52 -37.75 50.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.524 ' HB2' ' HG ' ' A' ' 132' ' ' CYS . 48.5 m -116.58 6.94 13.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.55 31.39 1.33 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.4 mtt85 -111.8 143.69 42.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.827 0.346 . . . . 0.0 110.862 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.5 m-85 -74.87 154.01 38.41 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -76.14 76.05 2.98 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -76.54 149.64 36.65 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -174.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.492 ' H ' ' HG1' ' A' ' 210' ' ' THR . 11.2 tp -98.75 119.09 36.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.966 -1.47 . . . . 0.0 107.614 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 44.5 t -113.07 146.74 38.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -105.46 92.67 4.29 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.497 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -76.03 -170.31 29.62 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' ND2' ' H ' ' A' ' 199' ' ' SER . 3.3 p-10 -11.22 -67.57 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.439 0.695 . . . . 0.0 112.812 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.528 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 56.9 m -153.22 12.41 0.48 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 0.0 109.89 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 51.7 m -128.4 -179.8 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.43 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 91.8 m95 -106.5 135.31 48.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 111.245 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.49 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 21.1 m-70 -127.53 173.54 9.78 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.916 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -129.06 128.49 67.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.236 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -144.94 172.09 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.746 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.99 95.98 7.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.39 -179.98 3.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.323 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -88.3 10.21 20.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.903 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -117.87 137.13 52.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.575 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.27 175.7 2.57 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.341 1.067 . . . . 0.0 113.039 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.492 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 32.5 m -168.76 121.65 0.82 Allowed 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.065 -1.88 . . . . 0.0 107.748 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.558 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.6 mt -74.33 130.55 39.9 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.837 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.2 m95 -118.44 125.32 49.69 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 121.416 0.627 . . . . 0.0 111.343 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.6 m -91.08 101.11 13.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.157 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.67 HG21 ' HG ' ' A' ' 22' ' ' LEU . 98.1 t -93.57 103.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.765 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.82 142.24 28.05 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.218 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.453 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.5 Cg_exo -63.6 104.23 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.218 1.946 . . . . 0.0 111.265 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 216' ' ' PRO . 2.2 mm . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.296 -0.859 . . . . 0.0 111.167 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 . . . . . 0 CA--C 1.517 -0.291 0 CA-C-O 120.93 0.395 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.28 123.18 27.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.405 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -109.49 157.08 19.34 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.016 0.436 . . . . 0.0 111.296 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.431 ' C ' ' H ' ' A' ' 18' ' ' ASP . 6.1 p -67.79 156.08 37.84 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.66 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.15 -9.18 1.18 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.771 -179.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.5 m-20 -67.88 132.61 47.68 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -79.47 122.28 26.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.5 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.1 m -138.26 171.44 15.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.548 HG13 HD11 ' A' ' 62' ' ' LEU . 3.4 m -132.71 136.49 55.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.163 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.666 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.9 mp -97.16 123.87 41.06 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.556 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -124.78 145.99 49.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.714 0.769 . . . . 0.0 112.326 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.3 p -132.88 143.64 49.65 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.711 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -86.88 120.23 27.94 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.992 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.404 ' HB1' HD13 ' A' ' 35' ' ' LEU . . . -109.81 119.2 38.62 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.372 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.3 m -123.66 141.73 51.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.345 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.47 HG12 ' ND1' ' A' ' 29' ' ' HIS . 21.2 tt -170.65 140.03 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.86 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.47 ' ND1' HG12 ' A' ' 28' ' ' ILE . 3.6 p-80 38.46 58.4 1.62 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.517 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 6.5 mmmm 58.27 35.61 25.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.965 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -139.0 113.78 9.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -117.95 148.07 42.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.455 ' OE1' HD22 ' A' ' 35' ' ' LEU . 3.6 pt20 -163.01 173.54 13.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.549 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.1 mtpt -118.56 136.84 53.63 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.668 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.5 mt -127.98 142.08 51.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.324 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.7 p -105.66 142.12 35.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.072 0.463 . . . . 0.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.466 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -63.71 112.9 3.06 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.047 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.452 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.49 164.07 13.72 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.581 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.9 165.0 14.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.597 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -139.44 146.4 40.04 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.656 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.15 10.84 59.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -121.29 153.58 37.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.743 0.306 . . . . 0.0 110.658 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.7 -135.89 15.07 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.318 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.436 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -87.13 8.21 24.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.658 0.266 . . . . 0.0 110.87 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.14 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.651 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 55.6 mt -80.32 140.44 36.14 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.773 0.32 . . . . 0.0 110.544 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 29.6 p -81.05 150.9 28.64 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 111.112 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -144.4 -166.47 2.39 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.838 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 48.3 mt -130.47 144.93 51.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.335 0.588 . . . . 0.0 112.208 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.9 mt-10 . . . . . 0 CA--C 1.503 -0.849 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.604 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.548 HD11 HG13 ' A' ' 21' ' ' VAL . 48.5 tp . . . . . 0 N--CA 1.457 -0.109 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.6 m -51.83 -46.78 64.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.268 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.452 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.3 pt -70.68 -18.72 21.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 32.5 m -99.9 12.33 37.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.716 0.293 . . . . 0.0 111.073 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -90.14 129.35 36.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 111.841 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -136.17 161.22 36.33 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.148 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.517 HG22 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.27 132.21 71.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.612 178.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.8 mt -80.84 65.81 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.466 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 13.2 mm-40 -44.67 -66.9 0.33 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.427 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -121.25 164.24 17.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.611 0.719 . . . . 0.0 112.895 -177.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -154.76 86.55 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.285 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 mt -113.91 154.47 27.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.387 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.2 t -68.58 146.25 53.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.0 t -45.86 -49.08 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.187 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -52.6 -53.84 41.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.926 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.77 -53.48 57.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.0 tp -51.49 -45.41 62.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.237 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 120.947 0.403 . . . . 0.0 110.284 179.646 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.735 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 12.7 mm-40 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.76 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.735 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 95.3 mttt -86.03 -50.43 7.05 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 120.13 1.332 . . . . 0.0 111.409 -2.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -54.45 -44.14 72.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.057 -177.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.611 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 98.8 mttt -56.07 -34.94 66.43 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.356 -179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.711 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -73.84 -42.48 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.705 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 56.1 tpp -57.33 -41.25 79.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.543 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 54.2 ttp -73.12 -43.03 62.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.554 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.643 ' HZ3' ' HB2' ' A' ' 103' ' ' LYS . 4.9 ttmp? -58.05 -42.59 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.055 0.455 . . . . 0.0 110.307 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.0 m -72.58 -40.43 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.9 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.86 -39.19 84.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.091 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.587 179.858 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.138 0.494 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.4 m -72.65 147.45 45.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.196 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.55 129.58 34.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.695 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.489 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -113.03 143.6 44.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.374 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.486 ' HD2' ' HG2' ' A' ' 173' ' ' GLU . 38.0 m-85 -62.66 143.9 56.86 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.115 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 86.07 -14.99 51.41 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.557 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.5 OUTLIER -79.81 141.98 35.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.138 0.494 . . . . 0.0 111.611 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.419 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.54 127.18 33.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.226 177.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.9 pt -112.0 162.62 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.575 0.702 . . . . 0.0 112.855 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.427 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.2 tp -117.36 109.95 17.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.96 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.1 mt -98.02 116.25 29.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.767 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.517 ' NH2' HG22 ' A' ' 68' ' ' VAL . 57.9 ttp85 -102.83 116.8 33.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.787 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.48 ' HD1' ' H ' ' A' ' 126' ' ' SER . 29.9 t-80 -59.39 107.1 0.52 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.6 t -48.66 -50.26 33.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.44 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.5 t80 -61.49 -66.67 0.5 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.48 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 57.9 p -67.41 -21.36 65.59 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.4 -2.01 68.69 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.157 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -83.06 -165.61 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.465 0.174 . . . . 0.0 110.659 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.464 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.3 m-85 -134.03 139.66 46.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.6 tp -55.55 125.31 20.45 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.7 t -133.84 148.23 51.28 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 50.5 t -95.07 98.13 10.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.508 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.67 155.75 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.263 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.8 t -86.43 6.61 29.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.943 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.8 p -92.32 124.21 36.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.655 0.264 . . . . 0.0 111.081 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 0.0 110.806 179.917 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.436 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.31 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.508 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.4 m-85 -104.79 176.07 5.28 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.433 177.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.41 141.75 28.22 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.58 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 59.9 t -111.21 125.87 68.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -141.41 -151.58 5.58 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.562 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 76.8 mt -115.77 143.94 44.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.042 0.448 . . . . 0.0 110.841 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -133.69 141.07 47.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.932 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.14 -64.02 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.54 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.89 149.1 36.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.716 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.1 p -103.46 1.32 32.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.948 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.2 p -55.69 114.46 1.88 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.73 -161.29 18.13 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.606 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.484 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.0 mt-10 -118.2 -11.38 10.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.75 0.31 . . . . 0.0 111.146 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.83 66.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.04 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.4 m -90.21 7.66 37.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.722 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -111.17 132.03 54.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.399 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.9 m95 -127.28 116.42 20.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.676 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 12.8 p -78.85 125.24 29.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.152 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 pt -87.03 137.07 21.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.818 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -130.8 149.21 73.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.264 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.56 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 23.7 Cg_endo -64.36 137.76 57.27 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.323 2.015 . . . . 0.0 112.244 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.1 49.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.742 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 68.6 m -113.15 -167.61 1.21 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 167' ' ' LYS . 8.1 tmtm? -91.41 1.48 57.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.78 -26.53 34.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.56 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 14.6 mmp_? -94.14 145.67 24.53 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.478 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 173' ' ' GLU . 69.4 m -111.63 152.63 27.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.047 -178.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.1 OUTLIER -71.72 132.11 44.07 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 79.77 -4.53 64.87 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 170' ' ' SER . 0.0 OUTLIER -79.16 154.8 29.02 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.66 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.401 ' N ' ' HG3' ' A' ' 173' ' ' GLU . 81.5 mttt -59.05 138.32 57.59 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.225 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 90.1 t -93.75 116.93 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.104 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . 0.422 ' HB2' ' OD2' ' A' ' 179' ' ' ASP . 11.1 mpt_? -80.03 154.01 28.45 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.177 0.513 . . . . 0.0 111.519 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 42.2 t -68.73 122.53 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 176.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.75 -13.5 35.13 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.23 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . 0.448 ' OD2' ' HD2' ' A' ' 169' ' ' ARG . 71.1 m-20 -68.36 129.1 38.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.79 0.329 . . . . 0.0 110.719 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -71.86 112.81 8.28 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 65.2 mt -97.29 150.66 20.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.834 0.826 . . . . 0.0 113.158 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 43.9 mt -115.21 113.97 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.99 135.01 35.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.001 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 191' ' ' TYR . 75.0 t -127.55 122.06 58.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.933 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 29.5 t -62.23 122.03 14.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.484 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -67.08 -30.86 50.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.025 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.49 -40.0 36.64 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.466 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.9 m -115.13 7.78 15.47 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.56 31.63 1.4 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 190' ' ' ARG . 4.9 mtt-85 -113.13 142.26 45.96 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.467 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -73.54 153.33 40.32 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.5 tp -75.12 76.33 2.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 175.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.2 t60 -76.32 151.29 36.73 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.93 115.19 29.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 113.604 -1.634 . . . . 0.0 107.731 177.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 67.7 m -107.86 147.46 30.91 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -106.72 92.26 4.03 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.512 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.47 -173.46 39.75 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.341 -0.933 . . . . 0.0 111.594 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' A' ' 197' ' ' GLY . 10.5 p-10 -5.55 -71.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.444 ' H ' ' CG ' ' A' ' 198' ' ' ASN . 54.3 m -151.97 13.83 0.61 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 31.2 t -127.86 -179.33 4.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.742 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.404 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 94.3 m95 -108.08 134.99 50.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.223 0.535 . . . . 0.0 111.321 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.456 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 20.4 m-70 -127.51 177.96 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.942 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . 0.457 HG12 ' SG ' ' A' ' 47' ' ' CYS . 3.0 p -132.36 130.2 60.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.47 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 54.7 p-10 -146.56 173.97 11.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.632 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.467 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.06 91.76 4.93 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.43 -179.51 3.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -87.73 5.03 41.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.484 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.474 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 65.8 mt-30 -112.99 137.95 50.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.635 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -64.86 175.23 1.56 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 122.35 1.072 . . . . 0.0 112.852 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.8 m -168.17 119.96 0.83 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 112.997 -1.911 . . . . 0.0 107.846 178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 25.1 mt -74.56 129.34 37.56 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.436 -0.505 . . . . 0.0 109.996 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 99.0 m95 -116.42 145.43 43.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.521 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -112.47 99.86 8.31 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.345 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.666 HG23 ' HG ' ' A' ' 22' ' ' LEU . 86.5 t -91.46 99.98 10.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.573 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.63 140.47 23.92 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.429 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.3 Cg_exo -62.36 103.97 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.097 1.865 . . . . 0.0 111.141 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.5 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.6 mm . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.295 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.8 mt -82.85 118.74 23.64 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.6 mmm180 -107.36 158.13 17.4 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.242 0.544 . . . . 0.0 111.342 -179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -68.41 154.44 41.81 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 72.46 -2.91 2.47 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.786 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.1 m-20 -73.82 138.44 44.45 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.741 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -84.34 121.18 27.17 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.486 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.7 m -137.5 169.73 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.527 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.7 137.04 56.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 114.678 -1.147 . . . . 0.0 108.277 176.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.3 mp -97.8 123.91 41.96 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.614 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.4 mt-30 -124.56 146.75 48.85 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.544 0.688 . . . . 0.0 112.194 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.23 143.67 49.28 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.746 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 m -86.56 120.48 27.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.213 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.423 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -111.74 121.09 44.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.179 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.8 m -125.75 133.13 52.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.004 0.43 . . . . 0.0 111.775 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.9 tt -169.85 146.56 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.382 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 57.68 43.7 21.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.02 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 58.91 23.57 11.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.364 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.03 144.12 50.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.371 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -132.0 147.6 52.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.917 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -161.35 171.13 18.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 21.6 mtpp -118.85 139.12 52.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.381 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.5 mt -127.9 144.24 51.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.303 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.6 p -108.37 139.83 42.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 0.0 110.693 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.472 ' HA ' HD22 ' A' ' 49' ' ' LEU . 32.1 tp -62.13 113.23 2.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.1 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.428 ' HB2' HD13 ' A' ' 64' ' ' ILE . . . -114.37 168.3 9.97 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.597 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -172.74 165.34 5.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.66 150.97 48.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.511 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.26 -0.35 88.58 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.816 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -113.96 153.87 28.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.868 0.366 . . . . 0.0 111.056 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.38 -128.24 8.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.523 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.494 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.0 t-20 -91.31 3.87 53.78 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.749 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 43.12 28.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.584 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 mt -81.31 133.87 35.5 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.418 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.445 ' HG ' ' HA2' ' A' ' 148' ' ' GLY . 76.7 m -72.63 150.2 43.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.551 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -145.94 -170.39 3.47 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.503 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 37' ' ' LEU . 24.1 mt -129.17 143.28 50.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.497 0.665 . . . . 0.0 112.45 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.4 mt-10 . . . . . 0 CA--C 1.502 -0.879 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.765 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.527 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp . . . . . 0 C--O 1.231 0.126 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.0 m -52.28 -50.22 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.428 HD13 ' HB2' ' A' ' 38' ' ' ALA . 29.8 pt -68.6 -17.34 22.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 51.4 m -100.27 11.4 39.47 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.826 0.346 . . . . 0.0 111.03 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -90.22 130.11 36.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.11 0.481 . . . . 0.0 111.689 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -136.45 160.83 37.58 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.102 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.3 t -124.83 132.57 71.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.863 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.408 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.6 mt -80.9 64.33 5.62 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.6 mm-40 -43.5 -64.02 0.73 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.414 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.5 mm100 -123.18 162.93 21.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.707 0.765 . . . . 0.0 112.888 -177.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.6 m -154.13 84.9 1.14 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.987 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 mt -113.18 154.19 27.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.187 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.516 ' HB3' HH12 ' A' ' 76' ' ' ARG . 47.4 t -67.76 149.1 50.37 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 48.5 t -49.94 -43.86 20.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.88 0.371 . . . . 0.0 110.276 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.516 HH12 ' HB3' ' A' ' 74' ' ' SER . 1.9 tmm_? -58.7 -52.94 63.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.22 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.403 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -59.51 -44.11 93.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.702 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.9 tp -62.24 -48.06 81.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.345 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 120.816 0.341 . . . . 0.0 110.543 179.851 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.642 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 10.8 mm-40 . . . . . 0 CA--C 1.531 0.25 0 CA-C-O 119.164 -0.446 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.642 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 25.1 tptp -87.75 -38.2 15.98 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 124.5 1.12 . . . . 0.0 109.942 -4.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -53.62 -44.64 69.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.697 -178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.565 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -61.69 -27.7 68.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.211 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.606 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 66.4 t80 -74.25 -49.44 23.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.501 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 97' ' ' LYS . 58.6 ttp -60.66 -38.84 86.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.846 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.1 mtp -72.13 -45.4 60.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.014 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -59.15 -41.07 87.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.837 0.351 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 55.2 p -71.91 -43.81 64.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.91 -29.59 70.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.797 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 . . . . . 0 CA--C 1.527 0.078 0 CA-C-O 121.373 0.606 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.4 m -81.49 150.55 28.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.838 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.42 130.44 35.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.734 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.5 mt -115.49 143.25 45.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.142 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.562 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.4 m-85 -63.97 129.68 41.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.039 0.447 . . . . 0.0 110.49 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.43 -11.71 58.25 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.944 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.01 141.09 31.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.091 0.472 . . . . 0.0 111.388 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.02 127.18 33.33 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 160' ' ' TRP . 40.5 pt -110.99 163.52 7.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.541 0.686 . . . . 0.0 112.602 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.414 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.5 tp -118.81 108.46 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.752 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.7 mt -96.75 117.47 31.11 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.739 -178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.485 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 18.9 ttp180 -104.02 116.69 32.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.553 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.491 ' HD1' ' H ' ' A' ' 126' ' ' SER . 26.8 t-80 -59.82 106.68 0.51 Allowed 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.7 t -49.83 -45.31 50.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.428 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 31.8 t80 -67.01 -59.88 3.11 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.491 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 12.9 m -74.72 -14.74 60.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.26 -2.84 26.05 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.376 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.405 ' HB2' ' HB3' ' A' ' 149' ' ' LEU . 50.1 mtt -82.95 -165.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.438 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.4 m-85 -132.94 138.9 47.07 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.2 tp -54.78 126.03 22.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.491 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 16.7 p -136.34 148.66 48.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.3 t -94.82 97.4 10.01 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.726 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -72.89 154.86 40.4 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.458 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -83.0 2.31 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.186 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.5 p -95.74 120.97 36.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.78 0.324 . . . . 0.0 111.107 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 78.0 p . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.551 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.377 0 CA-C-O 121.482 0.658 . . . . 0.0 112.085 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.495 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.2 m-85 -100.54 170.24 8.51 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.113 177.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -89.38 145.1 25.57 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.7 t -113.89 117.14 54.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.529 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . 0.445 ' HA2' ' HG ' ' A' ' 47' ' ' CYS . . . -134.23 -151.54 6.45 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.987 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.9 mt -115.71 141.72 47.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.423 . . . . 0.0 110.731 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.491 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -130.92 140.72 50.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.695 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.86 -69.01 0.37 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.585 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.96 148.41 46.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.685 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.0 p -104.21 0.16 29.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.127 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -55.54 112.77 1.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.436 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.17 -160.22 20.57 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.672 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 32.0 mt-10 -118.95 -10.73 9.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.98 -33.13 66.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 82.5 m -91.84 9.69 31.74 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.18 132.5 54.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 0.0 111.353 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.437 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -128.44 116.66 20.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.728 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 15.5 p -78.6 126.73 31.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.252 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.9 pt -88.93 136.77 22.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.879 0.371 . . . . 0.0 110.887 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -130.77 150.3 76.06 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.315 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.661 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 39.5 Cg_endo -66.49 141.01 59.52 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.664 2.242 . . . . 0.0 112.295 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.52 -46.31 48.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.78 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 21.3 t -113.61 -177.23 3.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.126 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.486 ' HD2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -85.31 15.23 4.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.281 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.486 HE22 ' HD2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -85.89 -36.25 20.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.196 0.522 . . . . 0.0 110.2 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.661 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.8 mmp_? -93.89 148.23 22.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.061 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 49.1 m -125.12 166.71 15.93 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.234 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.47 133.44 50.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.186 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 90.83 -12.07 69.95 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.302 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.8 mt-10 -72.42 154.6 40.8 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 120.999 0.428 . . . . 0.0 111.183 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -70.42 142.44 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.404 HG11 HD21 ' A' ' 181' ' ' LEU . 85.8 t -92.48 111.88 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.588 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 155.29 38.09 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 121.435 0.636 . . . . 0.0 111.49 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 41.5 t -71.37 120.41 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.2 -12.37 33.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.261 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.778 0.323 . . . . 0.0 110.859 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.1 m-20 -69.93 110.65 5.14 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 175' ' ' VAL . 70.2 mt -97.28 148.89 22.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.783 0.801 . . . . 0.0 113.088 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.503 HD13 ' NE2' ' A' ' 209' ' ' GLN . 52.6 mt -114.16 113.18 43.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.5 mp -93.34 137.51 32.58 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.0 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.5 t -129.19 126.85 64.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.61 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' SER . . . . . 0.541 ' HG ' ' H ' ' A' ' 188' ' ' SER . 41.2 t -66.09 127.72 33.25 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 99.5 t -71.22 -32.12 46.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.979 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -80.13 -35.69 36.34 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.541 ' H ' ' HG ' ' A' ' 185' ' ' SER . 53.5 m -116.94 4.79 12.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.42 31.8 1.39 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -113.58 141.05 47.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.019 0.437 . . . . 0.0 110.759 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 48.5 m-85 -71.5 153.71 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.41 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.23 75.61 2.36 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.08 150.36 38.88 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -174.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.3 tp -100.28 116.53 32.47 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 113.667 -1.606 . . . . 0.0 107.632 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.5 t -110.16 146.79 34.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -105.26 94.56 5.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.497 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.86 -169.51 33.81 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.961 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.9 p30 -11.54 -66.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.425 0.69 . . . . 0.0 112.714 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 53.1 m -154.62 11.92 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.193 0.52 . . . . 0.0 109.731 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 69.4 m -127.04 -178.69 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.851 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.423 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 93.3 m95 -107.64 135.69 48.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.167 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.491 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 16.9 m-70 -128.32 172.99 10.55 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.004 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.9 p -127.2 134.32 66.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.297 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.406 ' OD1' ' HB3' ' A' ' 206' ' ' ALA . 2.9 p30 -151.7 172.03 16.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.594 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.468 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.86 93.84 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.209 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.406 ' HB3' ' OD1' ' A' ' 204' ' ' ASP . . . -113.04 174.09 6.07 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.191 -177.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -83.08 9.35 10.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.01 135.54 54.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.678 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.503 ' NE2' HD13 ' A' ' 182' ' ' ILE . 92.4 mt-30 -65.61 175.56 1.8 Allowed 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.284 1.04 . . . . 0.0 113.028 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.9 m -168.73 122.32 0.85 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.144 -1.844 . . . . 0.0 107.936 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 55.1 mt -76.42 127.43 32.83 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.082 0.468 . . . . 0.0 109.969 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.412 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.4 m95 -114.81 146.98 40.43 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.682 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.9 t -114.15 100.8 8.65 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.163 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.709 HG21 ' HG ' ' A' ' 22' ' ' LEU . 78.4 t -92.6 102.02 13.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.74 141.04 25.43 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.113 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.428 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.86 103.41 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.129 1.886 . . . . 0.0 111.266 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.486 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 . . . . . 0 CA--C 1.519 -0.237 0 CA-C-O 120.778 0.323 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -80.18 122.63 27.07 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 11.2 mmm180 -111.63 157.84 19.95 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.059 0.457 . . . . 0.0 111.215 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.431 ' C ' ' H ' ' A' ' 18' ' ' ASP . 11.6 p -68.36 155.32 40.04 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.868 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.94 -8.37 1.29 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.639 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.439 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.7 m-20 -69.07 135.03 50.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.24 119.03 22.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.47 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.1 m -135.08 171.9 16.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.664 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.05 140.89 45.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.658 -1.156 . . . . 0.0 108.473 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.667 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.7 mp -101.52 121.1 41.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.689 0.281 . . . . 0.0 110.5 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -121.58 152.59 39.08 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.536 0.684 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.449 ' SG ' HD21 ' A' ' 194' ' ' LEU . 24.3 t -139.05 143.99 38.61 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.741 179.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.3 m -86.33 121.28 28.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.39 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.408 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -113.16 119.92 39.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.001 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.6 m -124.86 137.04 54.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.944 0.402 . . . . 0.0 111.582 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.7 tt -173.08 143.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.54 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.8 m80 58.91 37.41 24.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.877 0.37 . . . . 0.0 110.713 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.88 25.63 15.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.105 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -127.07 122.59 34.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.468 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -114.98 145.18 42.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.332 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.465 ' OE1' HD22 ' A' ' 35' ' ' LEU . 3.8 pt20 -157.63 171.15 20.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.563 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -118.56 134.83 54.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.59 178.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.465 HD22 ' OE1' ' A' ' 33' ' ' GLN . 1.6 mt -124.47 142.47 51.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.341 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 54.0 t -107.09 141.3 38.54 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.644 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 tp -61.01 113.22 2.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.992 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.445 ' HB2' HD13 ' A' ' 64' ' ' ILE . . . -112.15 164.74 12.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.271 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.35 162.32 10.32 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.694 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -133.18 146.7 51.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.831 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.89 3.34 85.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.788 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -114.08 152.18 31.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 110.972 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.02 -140.45 23.13 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.725 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -78.0 4.69 11.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.621 0.248 . . . . 0.0 111.147 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.25 31.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.158 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.3 mt -77.67 139.72 39.48 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.466 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.0 m -79.58 149.7 31.3 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.564 0.697 . . . . 0.0 111.284 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -145.18 -166.21 2.37 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.555 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.6 mt -130.47 145.21 51.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.438 0.637 . . . . 0.0 112.301 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.503 -0.851 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.769 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.578 HD13 HG13 ' A' ' 21' ' ' VAL . 47.3 tp . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -49.6 -48.14 49.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.445 HD13 ' HB2' ' A' ' 38' ' ' ALA . 29.6 pt -72.67 -17.88 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 111.467 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.664 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.69 -0.67 45.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.118 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 m -86.2 132.77 33.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.208 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -137.4 163.08 31.92 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.889 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.491 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.6 t -126.14 133.6 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.719 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 HG13 ' A' ' 20' ' ' VAL . 15.9 mt -82.58 64.35 7.18 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.484 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 9.1 mm-40 -43.7 -61.32 1.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -178.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -125.36 164.53 20.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 112.893 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.533 ' HG ' HG21 ' A' ' 119' ' ' ILE . 49.2 m -156.64 85.08 0.97 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.893 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mt -114.9 155.44 26.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.279 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.502 ' HG ' ' H ' ' A' ' 77' ' ' ALA . 80.3 p -68.6 148.52 50.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.2 t -50.03 -44.16 21.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.161 0.505 . . . . 0.0 110.235 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.0 ttp85 -57.91 -51.2 70.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.236 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.502 ' H ' ' HG ' ' A' ' 74' ' ' SER . . . -62.84 -43.06 99.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.706 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.83 -47.11 87.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.988 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 179.93 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.754 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 8.2 mm-40 . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.882 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.754 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 18.9 pttp -86.53 -50.53 6.78 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 120.349 1.431 . . . . 0.0 111.611 -2.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.485 ' H ' ' HG3' ' A' ' 97' ' ' LYS . 65.6 t-105 -56.55 -39.24 73.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.293 -1.321 . . . . 0.0 113.135 -177.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 51.6 tttp -61.39 -33.75 74.19 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.287 -179.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.749 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 24.5 t80 -73.93 -44.8 53.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.899 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 17.6 tpt -59.37 -39.17 82.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.65 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 53.1 ttp -71.0 -47.37 59.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.849 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -59.06 -45.01 91.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.1 m -66.98 -46.96 73.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.108 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.88 72.15 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.189 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.753 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.955 0.407 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.437 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 91.2 m -79.33 145.34 33.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.33 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.54 132.25 35.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.802 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -116.31 142.46 46.81 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.202 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.53 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.3 m-85 -62.56 129.82 42.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.083 0.468 . . . . 0.0 110.473 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.56 -12.21 58.14 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.56 140.42 32.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.971 0.415 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.98 128.31 33.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.533 HG21 ' HG ' ' A' ' 72' ' ' SER . 43.0 pt -112.42 158.62 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 112.747 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.1 tp -114.44 108.98 17.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.0 mt -97.35 115.6 28.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.691 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.491 ' NH2' HG21 ' A' ' 68' ' ' VAL . 64.9 ttp85 -102.22 116.42 32.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.712 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.452 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.6 t-80 -58.09 108.69 0.63 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 67.6 m -50.3 -53.3 29.58 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.452 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.8 t80 -56.82 -69.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.425 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 54.8 p -63.96 -31.96 73.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 89.24 -0.54 81.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.959 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.9 mtt -83.73 -165.82 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.432 -0.21 . . . . 0.0 110.432 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.484 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.3 m-85 -133.66 138.38 45.86 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.8 tp -54.07 125.96 20.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.465 ' HG ' ' HB2' ' A' ' 157' ' ' ALA . 47.6 t -135.13 149.93 50.1 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 40.8 t -96.69 97.12 9.1 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.476 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.7 mt -74.0 155.93 38.08 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.483 -178.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.3 m -84.93 2.37 43.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.856 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 48.0 p -89.16 124.55 34.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.692 0.282 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.434 0 CA-C-O 121.414 0.626 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.3 m-85 -101.9 174.28 6.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.93 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -93.65 142.55 27.22 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.54 118.68 58.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.97 5.91 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.713 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 54.3 mt -115.07 146.73 41.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.074 0.464 . . . . 0.0 110.67 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -138.72 139.72 38.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.848 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.81 -78.56 0.07 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.692 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.21 146.91 46.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.645 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 74.1 p -105.13 5.42 32.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.267 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.9 p -58.35 111.69 1.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.668 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.53 -163.35 19.53 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.937 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 30.8 mt-10 -116.35 -8.81 11.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.774 0.321 . . . . 0.0 111.261 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.465 ' HB2' ' HG ' ' A' ' 131' ' ' CYS . . . -57.84 -32.13 67.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.5 p -93.41 10.27 32.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.11 131.71 54.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.1 0.476 . . . . 0.0 111.479 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.413 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.6 m95 -126.63 116.76 21.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.912 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.9 p -78.62 127.09 31.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.167 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.9 pt -88.86 135.02 26.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.947 0.403 . . . . 0.0 110.953 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.5 m80 -127.26 149.88 70.9 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.217 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.58 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.41 138.07 49.23 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.522 2.148 . . . . 0.0 112.216 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.21 -40.3 52.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.565 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.2 p -108.63 -171.75 1.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.489 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -91.78 -8.0 47.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.203 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -71.42 -34.25 70.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.211 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 71.3 mmt-85 -89.99 146.3 24.47 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.708 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 40.8 t -129.19 168.18 16.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.976 0.417 . . . . 0.0 111.383 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.7 136.16 55.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.96 -17.3 51.85 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.293 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 170' ' ' SER . 24.1 mt-10 -67.3 155.99 37.52 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.919 0.39 . . . . 0.0 111.396 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.4 mttt -71.84 144.17 49.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.477 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 92.8 t -94.89 112.81 28.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.316 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -77.7 155.17 31.46 Favored 'General case' 0 CA--C 1.5 -0.964 0 CA-C-O 121.392 0.615 . . . . 0.0 111.471 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 53.0 t -69.2 121.82 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.72 -17.15 33.33 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.291 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -63.27 127.02 29.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.738 0.304 . . . . 0.0 110.824 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.408 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.6 m-20 -69.88 112.89 6.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.476 HD12 HG21 ' A' ' 214' ' ' VAL . 60.0 mt -98.19 149.01 23.01 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 48.6 mt -113.56 113.23 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.5 136.17 33.44 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.257 0.551 . . . . 0.0 112.354 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.406 HG23 ' CD1' ' A' ' 191' ' ' TYR . 70.8 t -129.03 125.25 62.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.545 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 45.4 t -64.5 126.55 28.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.77 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -69.77 -33.93 58.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.991 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.36 -36.32 39.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 56.3 m -116.3 5.45 13.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.07 31.26 1.53 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 31.4 mtt85 -112.04 142.67 44.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.899 0.38 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.9 m-85 -74.29 153.56 39.31 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -75.86 76.82 2.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 175.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -76.44 149.32 36.86 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 -174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.449 HD21 ' SG ' ' A' ' 24' ' ' CYS . 11.4 tp -100.33 114.64 28.3 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.634 177.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 41.6 t -107.17 147.33 30.23 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -106.45 91.39 3.68 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.532 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -76.14 -174.19 37.13 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.496 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 80.3 m-20 -5.6 -75.87 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.243 0.617 . . . . 0.0 112.457 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 35.8 t -146.32 14.4 1.27 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.097 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 59.3 m -128.33 -179.83 5.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.996 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.408 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.4 m95 -107.89 135.48 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.23 0.538 . . . . 0.0 111.243 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.481 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 17.3 m-70 -128.2 174.92 8.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.881 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.7 p -129.29 133.16 66.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.35 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.77 173.07 14.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.669 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.37 96.24 7.58 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.401 ' HB2' ' OD1' ' A' ' 204' ' ' ASP . . . -115.71 -179.5 3.67 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -88.44 10.72 19.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.424 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -118.99 134.88 54.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.058 0.456 . . . . 0.0 110.72 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.31 175.09 0.6 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.364 1.078 . . . . 0.0 112.844 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.412 HG22 ' SG ' ' A' ' 24' ' ' CYS . 22.8 m -168.65 119.35 0.76 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 112.979 -1.918 . . . . 0.0 107.782 178.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.7 mt -74.19 128.89 36.71 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.024 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.4 m95 -116.12 146.31 42.34 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.466 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -113.78 100.55 8.54 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.304 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.667 HG23 ' HG ' ' A' ' 22' ' ' LEU . 95.6 t -92.88 100.55 11.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.19 141.8 26.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.074 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 217' ' ' ILE . 26.8 Cg_exo -62.42 103.88 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.192 1.928 . . . . 0.0 111.265 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.47 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.311 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 . . . . . 0 CA--C 1.516 -0.354 0 CA-C-O 120.723 0.297 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.92 129.58 38.18 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -117.4 157.38 26.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.098 0.475 . . . . 0.0 111.103 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 18' ' ' ASP . 9.1 p -67.95 155.08 40.25 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.726 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.07 -7.8 1.43 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.699 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.418 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.9 m-20 -69.33 133.05 47.37 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.836 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.32 121.16 25.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.434 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 22.1 m -136.07 173.0 14.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.564 HG12 HD11 ' A' ' 62' ' ' LEU . 3.1 m -134.93 136.74 51.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.169 176.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.4 mp -98.06 124.86 42.77 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.655 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.428 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 71.9 mt-30 -124.91 145.01 50.03 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 121.664 0.745 . . . . 0.0 112.295 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.7 p -131.42 146.11 52.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.882 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -88.16 123.49 32.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.443 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -115.37 120.03 38.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.304 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.8 m -125.17 136.51 53.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.934 0.397 . . . . 0.0 111.685 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.0 tt -173.8 143.64 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.564 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 49.0 m80 61.15 32.63 19.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.734 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mmmm 67.74 22.31 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.075 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -126.06 124.61 41.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.511 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.16 147.28 41.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.208 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -158.21 172.98 17.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -120.4 136.02 54.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -125.3 145.28 50.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.391 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 28.9 p -107.42 140.09 40.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.08 0.467 . . . . 0.0 110.622 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.483 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -62.75 111.62 2.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.072 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB3' HD11 ' A' ' 64' ' ' ILE . . . -110.69 166.05 11.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.461 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.2 163.09 15.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.31 149.94 46.14 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.66 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.1 -5.25 89.32 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.755 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -107.39 157.35 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 0.0 110.938 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -141.57 23.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.368 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -83.34 9.54 10.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.683 0.278 . . . . 0.0 110.705 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.28 29.78 0.25 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.124 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -80.01 139.41 36.99 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.819 0.342 . . . . 0.0 110.512 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.582 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 31.5 p -78.71 148.15 33.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.364 0.602 . . . . 0.0 111.031 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -141.25 -165.57 1.99 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.001 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 29.7 mt -131.97 146.22 51.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.293 0.568 . . . . 0.0 112.374 -178.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.495 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 3.8 mt-10 . . . . . 0 CA--C 1.5 -0.952 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.718 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.564 HD11 HG12 ' A' ' 21' ' ' VAL . 49.2 tp . . . . . 0 C--O 1.232 0.137 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.4 m -50.94 -44.31 60.37 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.455 HD11 ' HB3' ' A' ' 38' ' ' ALA . 23.3 pt -73.07 -20.67 18.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 56.4 m -97.54 12.75 32.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.948 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.6 m -91.31 128.29 37.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.145 0.498 . . . . 0.0 111.729 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -136.09 161.53 35.45 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.129 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.514 HG23 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -125.46 132.43 71.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.5 mt -80.71 66.56 6.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 16.3 mm-40 -45.68 -64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -122.12 163.08 20.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.705 0.764 . . . . 0.0 112.826 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.3 m -154.69 85.9 1.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.427 -1.26 . . . . 0.0 108.771 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.9 158.09 20.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.538 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.9 p -70.49 146.49 50.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.446 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 50.7 t -48.63 -44.25 14.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.099 0.476 . . . . 0.0 110.539 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -57.98 -53.11 61.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.3 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -43.3 96.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.769 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.4 tp -62.03 -47.54 84.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.306 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 51.9 mt-30 . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 120.728 0.299 . . . . 0.0 110.741 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.697 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 119.233 -0.413 . . . . 0.0 110.715 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.697 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 84.9 mttt -89.84 -56.02 3.4 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-O 123.229 1.49 . . . . 0.0 108.547 -5.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.434 ' HA ' ' HB3' ' A' ' 101' ' ' MET . 76.4 m95 -77.06 -27.44 54.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 112.661 -2.063 . . . . 0.0 111.66 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -56.05 -58.76 6.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.895 -178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.576 ' HB3' ' HG3' ' A' ' 96' ' ' GLU . 2.5 t80 -77.26 -33.46 55.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.838 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.434 ' HB3' ' HA ' ' A' ' 98' ' ' TRP . 1.8 tmt? -56.31 -49.52 74.07 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.395 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.8 mtm -74.66 -43.41 55.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -57.15 -43.63 82.67 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.829 0.347 . . . . 0.0 110.963 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.9 m -72.58 -46.78 52.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.31 -34.46 66.54 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.366 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.003 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 . . . . . 0 CA--C 1.526 0.042 0 CA-C-O 121.036 0.445 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.418 HG23 ' HG2' ' A' ' 174' ' ' LYS . 86.2 m -79.93 145.27 32.73 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.105 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.29 131.19 35.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.659 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -115.34 142.7 46.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.199 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.58 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.9 m-85 -62.81 134.44 56.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.053 0.454 . . . . 0.0 110.5 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.06 -14.4 63.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.986 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.439 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -81.53 141.1 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.085 0.469 . . . . 0.0 111.361 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.72 128.41 34.34 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.156 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -113.11 160.43 12.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.638 0.732 . . . . 0.0 112.73 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 22.2 tp -116.52 108.82 16.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.94 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 52.3 mt -96.62 116.45 29.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.675 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.514 ' NH2' HG23 ' A' ' 68' ' ' VAL . 55.1 ttp85 -102.49 116.95 33.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.749 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.444 ' HD1' ' H ' ' A' ' 126' ' ' SER . 29.5 t-80 -59.2 107.6 0.57 Allowed 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 177.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 35.1 t -48.47 -54.78 12.95 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.426 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.1 t80 -56.82 -70.05 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.53 ' HG ' ' H ' ' A' ' 128' ' ' MET . 54.6 p -63.18 -28.81 70.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 86.83 -5.44 84.98 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.92 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.53 ' H ' ' HG ' ' A' ' 126' ' ' SER . 48.0 mtt -80.18 -165.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.446 0.165 . . . . 0.0 110.703 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.451 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.3 m-85 -134.02 140.21 46.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.36 126.25 24.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.0 t -135.18 148.28 49.64 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.1 t -94.83 97.92 10.38 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.511 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.32 147.37 40.21 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.0 t -78.34 2.35 18.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.587 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 40.5 p -87.97 121.67 30.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.578 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 121.534 0.683 . . . . 0.0 112.835 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.511 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -102.69 174.26 5.97 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.963 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -93.32 141.78 28.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.861 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.582 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 60.9 t -111.31 125.97 68.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -144.15 -150.69 5.3 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.757 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 66.5 mt -114.62 144.55 43.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.149 0.5 . . . . 0.0 110.969 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -137.29 137.95 39.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.677 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.45 -76.15 0.08 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.48 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -63.89 146.46 53.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.7 p -103.33 -0.66 29.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.035 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.8 p -54.97 112.26 1.01 Allowed 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.411 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 130.12 -161.55 23.08 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.52 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.447 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -118.68 -15.25 9.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 0.0 111.493 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.25 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.1 m -88.05 5.45 40.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.62 0.248 . . . . 0.0 111.613 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -110.88 132.69 53.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.103 0.478 . . . . 0.0 111.261 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.432 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.5 m95 -127.34 117.77 22.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.704 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.503 ' HG1' ' HB ' ' A' ' 184' ' ' VAL . 11.2 p -79.26 126.46 30.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.111 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.6 pt -88.5 135.13 26.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.932 0.396 . . . . 0.0 110.976 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.414 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.9 m80 -127.71 151.65 75.71 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.209 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.659 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.7 Cg_endo -68.07 140.31 49.36 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.519 2.146 . . . . 0.0 112.454 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.12 -47.27 52.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.843 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.435 ' HB3' ' NE2' ' A' ' 168' ' ' GLN . 62.2 m -111.82 -170.96 1.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.238 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.2 15.24 12.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.093 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.435 ' NE2' ' HB3' ' A' ' 166' ' ' SER . 2.4 mp0 -86.75 -35.18 19.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.21 0.529 . . . . 0.0 110.367 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.659 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -94.54 153.74 17.74 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.176 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.3 m -133.93 166.86 21.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.885 0.374 . . . . 0.0 111.342 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.03 132.2 48.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.524 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.39 -16.35 60.11 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.2 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -68.73 157.97 35.23 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.003 0.43 . . . . 0.0 111.158 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.418 ' HG2' HG23 ' A' ' 112' ' ' THR . 38.9 mttp -74.12 143.13 45.47 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.442 HG12 HD21 ' A' ' 181' ' ' LEU . 99.5 t -93.17 115.05 31.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.265 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.7 mpt_? -78.93 155.01 29.2 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-O 121.298 0.571 . . . . 0.0 111.615 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 39.0 t -69.42 121.13 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.47 -11.95 36.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.374 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -68.2 127.62 33.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.764 0.316 . . . . 0.0 110.731 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -69.7 110.36 4.85 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.442 HD21 HG12 ' A' ' 175' ' ' VAL . 71.2 mt -96.37 148.54 22.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.757 0.789 . . . . 0.0 113.127 -178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.414 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 54.5 mt -113.53 112.86 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -92.82 138.26 31.64 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.157 0.504 . . . . 0.0 112.052 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.503 ' HB ' ' HG1' ' A' ' 161' ' ' THR . 77.9 t -130.33 120.45 48.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.001 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' SER . . . . . 0.423 ' HG ' ' H ' ' A' ' 190' ' ' ARG . 99.9 p -61.04 123.01 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.626 178.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 89.3 t -66.59 -33.19 61.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -76.04 -39.96 54.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 49.7 m -113.95 5.37 16.14 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.91 29.86 1.79 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 34.8 mtt85 -110.34 143.21 40.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.899 0.381 . . . . 0.0 110.838 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.483 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 56.5 m-85 -74.53 153.83 38.9 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.406 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.4 tp -75.68 76.22 2.67 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 105.322 -2.103 . . . . 0.0 105.322 175.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -76.4 151.79 36.46 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.7 tp -101.12 116.21 32.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 113.604 -1.635 . . . . 0.0 107.537 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 46.8 p -109.0 146.95 33.06 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -105.77 91.08 3.6 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.53 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.32 -174.17 40.62 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.329 -0.938 . . . . 0.0 111.594 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.53 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.7 m120 -3.09 -76.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.341 0.656 . . . . 0.0 112.496 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.0 p -147.39 14.3 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.064 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.2 t -128.12 -179.7 5.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.443 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 94.2 m95 -107.36 135.22 49.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.265 0.555 . . . . 0.0 111.294 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.488 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.7 m-70 -127.93 176.79 7.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.01 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . 0.423 HG12 ' SG ' ' A' ' 47' ' ' CYS . 2.7 p -131.47 131.51 62.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.337 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -148.93 173.93 12.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.487 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -98.92 96.1 7.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.86 -179.51 3.65 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.252 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -87.97 7.21 32.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -115.39 136.21 53.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.452 . . . . 0.0 110.687 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.411 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.7 mt-30 -64.57 174.68 1.65 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.371 1.081 . . . . 0.0 112.695 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -166.61 119.38 1.02 Allowed 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.093 -1.867 . . . . 0.0 107.826 178.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 47.7 mt -73.16 128.82 36.58 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.514 -0.474 . . . . 0.0 109.948 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.3 m95 -116.2 145.05 43.41 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.596 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.8 t -112.02 100.49 8.91 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.695 HG23 ' HG ' ' A' ' 22' ' ' LEU . 97.3 t -92.52 100.66 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.75 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.24 142.25 27.73 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.087 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.53 104.33 0.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.071 1.847 . . . . 0.0 111.029 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.434 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 5.7 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.368 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.4 mt -78.16 124.37 27.98 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.41 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.8 mmm180 -111.49 158.03 19.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.982 0.42 . . . . 0.0 111.087 -179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.429 ' C ' ' H ' ' A' ' 18' ' ' ASP . 4.7 p -68.09 155.23 40.01 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.889 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.1 -7.3 1.34 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.676 -179.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.2 m-20 -68.3 136.16 53.03 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.064 0.459 . . . . 0.0 110.974 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -82.81 119.53 24.48 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.5 m -136.29 173.12 14.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.63 139.48 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.278 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.6 mp -99.97 120.56 39.99 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.672 0.272 . . . . 0.0 110.67 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -123.07 142.14 51.2 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.454 0.645 . . . . 0.0 112.185 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.446 ' SG ' HD21 ' A' ' 194' ' ' LEU . 19.6 t -127.92 146.66 50.57 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.866 178.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.0 m -87.98 122.34 31.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.267 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.419 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -113.76 122.64 47.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.347 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.2 m -125.68 140.21 52.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.447 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 tt -175.48 139.45 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.761 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.8 m80 57.86 43.19 21.99 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.409 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.5 mppt? 60.27 23.73 13.14 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.296 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -126.52 123.13 37.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.607 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -117.53 151.25 37.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.195 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -163.36 172.7 14.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.79 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -118.98 138.09 53.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.583 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -129.1 139.1 52.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.311 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.564 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 45.3 t -102.09 145.85 28.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.879 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HA ' HD22 ' A' ' 49' ' ' LEU . 30.7 tp -66.9 116.83 8.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.755 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.441 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . . . -116.48 162.44 17.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.591 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.22 165.56 21.87 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.753 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.58 144.49 39.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.569 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.91 51.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.436 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -123.24 147.59 46.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.847 0.356 . . . . 0.0 110.639 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.12 -139.81 21.58 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.411 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.3 OUTLIER -78.85 4.66 13.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.72 0.295 . . . . 0.0 110.779 179.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.48 32.42 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.908 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.412 ' H ' HD21 ' A' ' 44' ' ' ASN . 40.4 mt -77.6 139.97 39.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.032 0.444 . . . . 0.0 110.472 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.6 m -79.73 151.14 30.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.556 0.693 . . . . 0.0 111.347 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -147.05 -167.85 2.89 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.622 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.7 mt -131.0 145.67 52.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 112.321 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 46.5 mt-10 . . . . . 0 CA--C 1.494 -1.192 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.921 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.519 HD12 HG12 ' A' ' 21' ' ' VAL . 57.4 tp . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.2 t -51.58 -52.7 45.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.68 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 37.9 pt -71.57 -14.46 17.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.53 -3.26 46.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.428 0.632 . . . . 0.0 110.059 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.42 HG22 ' OG ' ' A' ' 124' ' ' SER . 37.7 m -84.77 134.11 34.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.123 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -137.66 162.13 34.65 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.782 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.51 HG23 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -125.62 133.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.733 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 mt -82.32 63.77 6.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.473 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.5 mm-40 -43.7 -61.03 1.53 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -178.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -124.97 163.93 21.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.708 0.766 . . . . 0.0 112.977 -177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.32 84.38 0.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.363 -1.29 . . . . 0.0 108.995 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.45 154.83 25.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.367 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.4 p -67.88 147.12 52.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.432 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.7 t -49.44 -44.99 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.088 0.47 . . . . 0.0 110.354 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -56.65 -54.21 48.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.227 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.77 97.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.9 tp -59.78 -49.3 78.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.065 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 24.4 mt-30 . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.755 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.764 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.3 mm-40 . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.764 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -87.06 -50.77 6.42 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-N 120.45 1.477 . . . . 0.0 111.624 -2.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.632 ' H ' ' HG2' ' A' ' 97' ' ' LYS . 4.7 m-90 -66.24 -28.68 68.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.941 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.682 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -61.17 -39.47 90.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.174 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.654 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 36.3 t80 -74.28 -42.24 59.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.785 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.6 tpt -56.64 -49.42 75.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.932 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.2 mtm -71.54 -38.04 71.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -57.56 -45.76 84.75 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.859 0.361 . . . . 0.0 110.512 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.7 p -72.96 -39.28 66.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.701 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.02 69.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.074 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 179.898 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 . . . . . 0 CA--C 1.527 0.064 0 CA-C-O 121.073 0.463 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.3 m -75.76 148.09 38.77 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.052 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -81.34 131.63 35.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.837 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 77.9 mt -116.03 141.55 47.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.218 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.505 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 36.9 m-85 -61.56 130.71 47.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.458 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.31 -12.7 60.15 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.037 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.99 141.53 32.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.12 0.485 . . . . 0.0 111.27 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.58 127.77 33.67 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.4 pt -112.77 159.42 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.556 0.693 . . . . 0.0 112.746 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.1 tp -115.07 109.7 18.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.864 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.9 mt -97.4 116.97 30.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.629 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.51 ' NH2' HG23 ' A' ' 68' ' ' VAL . 60.4 ttp85 -103.4 116.01 31.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.777 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.476 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.5 t-80 -58.27 108.16 0.58 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 177.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.42 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -51.72 -48.33 63.64 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.476 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 68.7 t80 -61.21 -64.63 0.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.438 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 53.4 p -72.12 -19.87 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 77.9 -0.19 73.06 Favored Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.236 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.6 mtt -83.32 -165.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.411 0.148 . . . . 0.0 110.636 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.2 m-85 -133.75 138.53 45.81 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 22.1 tp -55.39 127.4 29.35 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 20.5 p -137.02 150.01 47.83 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.0 t -95.36 99.53 11.45 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.589 -1.264 . . . . 0.0 107.589 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.5 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.2 mt -75.45 152.74 37.89 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.888 -178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.6 p -78.53 -5.71 53.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.81 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 31.1 p -85.32 124.16 31.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.729 0.299 . . . . 0.0 110.884 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 51.6 m . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.308 0.575 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.0 m-85 -101.23 172.46 6.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.029 177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.06 142.93 27.23 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 62.9 t -111.48 117.52 55.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.383 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.35 -150.28 5.99 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.082 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.6 mt -115.14 146.36 41.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.036 0.446 . . . . 0.0 111.029 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.474 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 7.2 tp60 -137.62 143.65 41.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.705 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.37 -50.75 12.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -81.82 143.25 31.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' THR . . . . . 0.434 ' HA ' ' HG ' ' A' ' 158' ' ' CYS . 77.6 p -106.49 -6.66 17.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 66.8 p -54.84 114.23 1.64 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.46 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.28 -158.15 21.51 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.462 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.458 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.4 mt-10 -121.11 -12.48 8.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.765 0.317 . . . . 0.0 111.357 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.57 -32.15 68.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.122 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . 0.434 ' HG ' ' HA ' ' A' ' 153' ' ' THR . 79.7 m -90.86 6.2 45.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.718 0.295 . . . . 0.0 111.593 -179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -110.07 134.07 52.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.015 0.436 . . . . 0.0 111.365 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.449 ' O ' HG12 ' A' ' 119' ' ' ILE . 51.7 m95 -128.02 117.41 21.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.611 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.405 HG23 HG21 ' A' ' 186' ' ' VAL . 13.5 p -78.84 125.89 29.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.057 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.3 pt -88.13 136.17 23.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.919 0.39 . . . . 0.0 110.89 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.23 150.17 73.29 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.605 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.5 Cg_endo -66.16 137.58 48.51 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.377 2.051 . . . . 0.0 112.407 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.51 -40.93 41.13 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.289 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 58.6 m -103.49 -173.55 2.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.406 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.411 ' O ' ' HD3' ' A' ' 167' ' ' LYS . 14.0 tmtt? -95.22 -2.12 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.931 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.09 -33.31 44.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.035 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.605 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 58.7 mmt-85 -86.88 144.86 26.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.606 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 48.8 m -127.23 167.93 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.327 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.7 134.21 51.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.1 59.5 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.285 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -67.93 156.98 36.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 63.3 mttt -73.56 141.68 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.366 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.417 HG12 HD22 ' A' ' 181' ' ' LEU . 97.4 t -91.82 113.64 27.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.358 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -78.43 154.79 30.34 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.337 0.589 . . . . 0.0 111.57 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 48.0 t -69.96 122.16 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.322 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.26 -11.55 36.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.07 127.71 33.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.891 0.376 . . . . 0.0 110.935 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.424 ' HA ' ' O ' ' A' ' 212' ' ' TRP . 6.8 m-20 -69.82 114.02 7.61 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.417 HD22 HG12 ' A' ' 175' ' ' VAL . 70.1 mt -99.78 149.5 23.29 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.471 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.9 mt -114.3 112.3 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -92.24 138.12 31.79 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.063 0.459 . . . . 0.0 112.048 -178.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.42 HG22 ' CD1' ' A' ' 191' ' ' TYR . 80.0 t -130.48 127.99 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.709 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.8 m -64.59 123.16 18.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.458 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.2 t -67.44 -30.26 48.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.832 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.9 t -79.13 -38.38 36.22 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.448 ' HB2' HH11 ' A' ' 190' ' ' ARG . 94.2 p -120.52 10.61 11.17 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 45.29 33.07 1.12 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.493 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 39.1 mtt85 -109.01 138.39 45.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.961 0.41 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.489 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 52.5 m-85 -72.2 153.06 41.83 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.404 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.4 tp -75.28 75.5 2.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -74.15 151.12 40.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -174.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.446 HD21 ' SG ' ' A' ' 24' ' ' CYS . 13.2 tp -101.53 115.8 31.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.721 -1.582 . . . . 0.0 107.645 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.4 p -109.28 145.83 35.3 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -105.7 92.45 4.18 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.73 -174.3 46.39 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.266 -0.968 . . . . 0.0 111.368 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 39.6 m-80 -1.14 -78.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.298 0.639 . . . . 0.0 112.52 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.6 p -146.68 12.87 1.16 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.07 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 49.9 m -126.74 -178.45 4.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 94.0 m95 -108.53 135.47 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.281 0.563 . . . . 0.0 111.328 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.451 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 22.8 m-70 -127.66 175.33 8.37 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.064 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.23 133.69 63.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.443 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.417 ' OD1' ' HB1' ' A' ' 206' ' ' ALA . 2.8 p30 -150.7 172.15 16.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.605 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.493 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -98.77 95.99 7.59 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.417 ' HB1' ' OD1' ' A' ' 204' ' ' ASP . . . -114.93 179.18 4.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.325 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -87.21 8.16 25.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.835 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 37.2 mt-30 -114.16 134.98 54.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.721 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.471 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.4 mt-30 -64.05 174.32 1.58 Allowed 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.296 1.046 . . . . 0.0 112.742 -178.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -167.85 121.6 0.94 Allowed 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 113.102 -1.863 . . . . 0.0 107.912 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 41.1 mt -76.37 130.31 37.88 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.122 0.487 . . . . 0.0 109.885 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.1 m95 -117.54 147.58 42.66 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.705 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -114.02 99.19 7.46 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.377 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.7 HG21 ' HG ' ' A' ' 22' ' ' LEU . 94.8 t -91.85 100.78 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.759 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.83 140.69 25.76 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.092 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.405 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.9 Cg_exo -62.1 104.69 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.079 1.853 . . . . 0.0 111.251 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.235 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-O 120.755 0.312 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.7 mt -81.96 120.5 25.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 15' ' ' ARG . 7.8 mmm180 -109.12 158.65 17.58 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.99 0.424 . . . . 0.0 111.035 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.404 ' C ' ' H ' ' A' ' 18' ' ' ASP . 4.5 p -67.75 157.22 35.19 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.793 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 69.03 -2.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.877 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.0 m-20 -74.25 134.36 42.66 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.468 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -79.68 119.37 22.52 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.469 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.9 m -136.88 169.64 19.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.653 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -132.22 140.28 48.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 108.398 176.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.689 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.8 mp -100.22 122.01 42.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.691 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -122.15 151.77 40.62 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.527 0.679 . . . . 0.0 111.889 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.1 p -137.57 140.8 41.23 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.808 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -83.26 122.82 28.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.157 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.436 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.81 120.96 40.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.4 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.3 m -125.66 140.15 52.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.428 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.1 tt -175.71 143.13 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.642 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.1 m80 58.09 39.23 26.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.749 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.25 26.22 15.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.049 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -129.26 122.84 30.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.575 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.02 149.15 39.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -161.16 174.15 14.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.67 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -120.98 135.19 55.27 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.504 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.491 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.2 mt -125.18 142.33 51.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.553 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 43.8 t -106.44 142.97 35.23 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.894 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 49' ' ' LEU . 27.0 tp -63.49 115.61 4.81 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.795 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.409 ' HB1' ' HG3' ' A' ' 50' ' ' GLU . . . -116.19 164.69 14.11 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.683 -179.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.82 165.47 9.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.683 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.93 144.64 39.15 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.627 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -82.26 17.55 17.83 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.662 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -126.75 151.95 47.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 0.0 110.446 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.15 -135.86 15.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.262 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -85.56 8.12 20.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.706 0.289 . . . . 0.0 110.78 179.649 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.0 29.23 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.922 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.438 ' H ' HD21 ' A' ' 44' ' ' ASN . 42.9 mt -78.11 142.25 38.21 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 120.974 0.416 . . . . 0.0 110.55 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.62 151.4 25.34 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.512 0.672 . . . . 0.0 111.098 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -144.9 -167.58 2.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.763 -1.108 . . . . 0.0 108.555 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.489 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.36 142.6 50.1 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.402 -0.519 . . . . 0.0 112.305 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 48.1 mt-10 . . . . . 0 CA--C 1.495 -1.147 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.158 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.523 HD11 HG13 ' A' ' 21' ' ' VAL . 50.5 tp . . . . . 0 C--O 1.231 0.097 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -50.07 -51.09 45.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.744 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.05 -15.97 18.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.887 0.375 . . . . 0.0 111.593 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.653 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.97 -1.52 45.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.339 0.59 . . . . 0.0 110.307 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.0 m -85.92 135.65 33.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.022 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.16 161.88 36.32 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -125.73 132.88 70.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.65 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 mt -82.01 66.93 7.8 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.2 mm-40 -46.28 -62.5 1.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -121.67 165.72 15.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.667 0.746 . . . . 0.0 112.963 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -158.93 82.72 0.79 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.9 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -111.37 156.55 21.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.413 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.0 t -69.77 147.15 50.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.22 -45.33 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.477 . . . . 0.0 110.254 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 ttp85 -55.5 -54.72 40.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.295 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.41 -45.17 94.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.015 -179.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.0 tp -59.93 -46.54 89.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.394 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 120.928 0.394 . . . . 0.0 110.772 -179.987 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.706 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 12.6 mm-40 . . . . . 0 CA--C 1.534 0.341 0 CA-C-O 118.861 -0.59 . . . . 0.0 112.224 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.706 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.7 ptmt -86.55 -44.15 12.15 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.971 1.308 . . . . 0.0 110.826 -3.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -53.35 -49.42 67.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.219 -1.355 . . . . 0.0 112.731 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 55.3 mtpt -55.48 -30.59 60.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.667 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.678 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.2 t80 -73.81 -48.23 32.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.026 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.09 -42.51 85.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.11 -39.43 72.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.653 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -60.61 -39.91 89.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.542 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.6 m -72.39 -49.16 35.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.256 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.98 78.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.495 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.015 -179.811 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 121.022 0.439 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.5 m -75.81 148.38 38.46 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.027 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -81.74 129.58 34.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.437 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -114.92 143.13 45.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.252 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 35.6 m-85 -62.57 133.23 54.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.024 0.44 . . . . 0.0 110.471 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.7 -11.64 64.59 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.048 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.09 139.74 32.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.982 0.42 . . . . 0.0 111.356 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.26 128.71 34.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.434 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.8 pt -113.39 159.22 13.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.547 0.689 . . . . 0.0 112.792 -178.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.0 tp -115.4 108.39 16.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 48.3 mt -95.76 118.11 31.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.665 -179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.452 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 19.7 ttp180 -103.75 115.36 30.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.669 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.1 t-80 -57.44 109.5 0.7 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.9 m -52.75 -48.81 66.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.48 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 77.4 t80 -61.6 -62.5 1.76 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.44 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 54.7 p -73.26 -20.74 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.81 -1.23 74.46 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.084 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.3 mtt -83.37 -165.92 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.461 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 60.0 m-85 -133.03 139.06 47.02 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.2 tp -54.42 129.53 36.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.4 t -138.81 147.32 42.39 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.6 t -94.04 98.05 10.74 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.479 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -73.74 156.83 37.46 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.559 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.0 m -81.61 -10.38 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.432 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -87.13 123.75 32.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.711 0.291 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 57.9 m . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.564 0 CA-C-O 121.326 0.584 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 15.7 m-85 -103.17 169.43 8.56 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.928 178.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -88.26 144.09 26.64 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 99.1 t -113.51 116.09 51.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.463 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.72 -147.89 5.76 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.323 -0.941 . . . . 0.0 112.695 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 70.2 mt -116.3 153.49 31.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.828 0.346 . . . . 0.0 110.618 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -143.62 139.21 29.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.81 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.96 -69.24 0.36 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.473 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.75 143.77 51.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.589 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 52.3 p -103.15 1.32 33.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.349 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -56.23 115.12 2.27 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.56 -161.89 18.9 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.613 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.476 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 33.8 mt-10 -117.07 -11.25 10.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.815 0.341 . . . . 0.0 111.273 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.71 67.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 83.8 m -92.22 9.45 33.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.22 132.5 54.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.099 0.476 . . . . 0.0 111.361 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.434 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.4 m95 -127.45 117.15 21.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.597 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 7.4 p -79.06 128.14 32.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.267 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 pt -89.48 133.41 31.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 111.052 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.441 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.5 m80 -126.57 150.15 69.99 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.2 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.646 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.3 Cg_endo -67.54 137.52 42.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.519 2.146 . . . . 0.0 112.065 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.29 -43.42 56.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.688 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 54.9 m -106.88 -174.04 2.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.039 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.63 8.06 40.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.157 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -83.83 -34.67 24.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.853 -179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.646 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -90.02 148.23 23.19 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.531 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.1 m -128.13 167.15 17.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.98 135.76 55.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 89.29 -16.88 54.85 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.395 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -67.41 154.97 40.13 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.924 0.393 . . . . 0.0 111.161 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -71.87 142.15 49.56 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 178.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 92.5 t -91.53 113.03 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.755 0.312 . . . . 0.0 110.412 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -75.51 152.96 37.75 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.34 0.591 . . . . 0.0 111.5 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 25.6 t -68.94 121.43 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.69 -11.9 35.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.342 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.36 130.34 42.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.831 0.348 . . . . 0.0 110.905 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.46 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 13.2 m-20 -71.95 112.18 7.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.401 HD13 HG21 ' A' ' 214' ' ' VAL . 76.5 mt -98.13 150.07 21.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.4 mt -114.32 112.89 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -92.75 136.28 33.38 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.191 0.52 . . . . 0.0 112.129 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 191' ' ' TYR . 73.7 t -128.74 126.27 64.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.862 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 5.3 m -63.93 125.47 24.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -70.63 -32.05 48.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.682 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.7 t -81.21 -36.31 30.23 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 53.1 m -114.98 5.51 15.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 45.22 33.16 1.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -116.09 142.47 46.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.989 0.424 . . . . 0.0 110.772 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.8 m-85 -72.6 153.84 41.06 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 27.3 tp -75.31 76.45 2.41 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 175.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -75.54 150.74 38.05 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.457 ' H ' ' HG1' ' A' ' 210' ' ' THR . 15.6 tp -101.59 114.39 28.39 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.705 177.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' SER . . . . . 0.401 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 48.2 t -107.88 146.24 32.6 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -177.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . 0.407 ' HH ' ' HA ' ' A' ' 199' ' ' SER . 80.3 t80 -106.41 91.2 3.6 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 177.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.02 -179.73 52.98 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.032 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 35.1 m-80 7.65 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.23 0.612 . . . . 0.0 112.386 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.407 ' HA ' ' HH ' ' A' ' 196' ' ' TYR . 49.7 m -142.19 5.71 1.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.349 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.1 m -120.89 -179.31 3.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.206 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.436 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.6 m95 -106.27 139.3 40.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.274 0.559 . . . . 0.0 111.198 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.44 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 32.4 m-70 -130.26 172.08 12.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.962 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.88 132.6 69.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.295 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 206' ' ' ALA . 2.8 p30 -150.31 170.19 19.6 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.588 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.49 93.77 6.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.307 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.412 ' HB2' ' OD1' ' A' ' 204' ' ' ASP . . . -113.07 175.8 5.29 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.268 -177.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.02 10.66 9.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.195 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -117.6 136.5 53.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.684 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -64.56 175.61 1.35 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.434 1.111 . . . . 0.0 113.151 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.457 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 23.7 m -169.49 120.07 0.68 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 112.919 -1.946 . . . . 0.0 107.721 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 31.6 mt -74.76 128.91 36.71 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.923 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.35 144.88 43.1 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.566 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.9 t -112.44 101.18 9.37 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.428 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.689 HG23 ' HG ' ' A' ' 22' ' ' LEU . 99.6 t -92.68 100.48 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.779 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -111.46 142.15 25.92 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.45 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.1 Cg_exo -63.68 103.73 0.41 Allowed 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.209 1.939 . . . . 0.0 111.365 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.469 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.926 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.6 mt -80.73 122.59 27.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.4 mmm180 -109.75 157.29 19.29 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 111.182 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.451 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.1 p -67.82 156.45 37.07 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.763 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.74 -9.9 1.03 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.69 -179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.451 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.9 m-20 -67.72 134.09 50.45 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -79.8 120.41 24.03 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.406 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.7 m -136.35 172.99 14.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.662 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -135.16 139.23 47.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.304 176.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.733 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.2 mp -100.04 122.62 43.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.529 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -123.04 146.02 48.03 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.625 0.726 . . . . 0.0 112.223 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -131.38 142.56 50.07 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.752 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.7 m -84.25 120.95 26.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.322 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.415 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -113.99 117.51 31.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.216 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.1 m -122.02 137.02 54.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.023 0.44 . . . . 0.0 111.731 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -171.89 144.8 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.496 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.3 m80 60.19 34.84 21.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt 64.19 25.43 13.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.133 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -128.37 126.66 41.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.177 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -116.26 141.86 47.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 111.571 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -151.59 174.39 13.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.633 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -122.28 135.54 54.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.645 178.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -124.62 141.58 51.99 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.523 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.615 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.3 t -104.76 142.34 34.89 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.684 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.485 ' HA ' HD22 ' A' ' 49' ' ' LEU . 35.7 tp -60.93 112.93 2.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.684 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.73 163.4 14.19 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.515 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.73 160.21 10.39 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.405 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.7 141.85 48.78 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.622 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.82 16.36 21.11 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.193 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -122.13 148.52 44.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 0.0 110.714 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.58 -138.39 20.24 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.583 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -81.54 8.83 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.644 0.259 . . . . 0.0 110.971 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.08 31.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.249 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.9 mt -78.31 138.65 38.69 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 110.556 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.3 m -79.86 151.47 30.19 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.631 0.729 . . . . 0.0 111.413 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.71 -161.9 1.42 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.558 -1.201 . . . . 0.0 108.348 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.485 HD22 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -132.89 145.36 50.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.0 112.066 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.4 tt0 . . . . . 0 CA--C 1.503 -0.847 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.526 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.574 HD12 HG13 ' A' ' 21' ' ' VAL . 44.8 tp . . . . . 0 CA--C 1.527 0.09 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.3 p -46.83 -51.87 15.56 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 32.1 pt -71.38 -17.32 19.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.662 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.19 -1.33 42.35 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.937 0.399 . . . . 0.0 111.452 -179.233 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.409 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.1 m -84.66 132.9 34.42 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -137.07 162.91 32.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.971 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -126.27 133.92 67.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.4 mt -82.64 66.55 8.3 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 11.7 mm-40 -45.5 -64.62 0.69 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.401 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -122.98 165.26 17.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.773 0.797 . . . . 0.0 113.033 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.8 m -156.11 86.12 1.03 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.114 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.5 mt -112.96 157.09 21.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.514 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.7 t -69.65 146.86 51.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.9 t -50.36 -45.73 25.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.12 0.486 . . . . 0.0 110.236 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -57.18 -51.57 68.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.218 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -44.63 96.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.789 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.72 -46.75 89.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.263 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 . . . . . 0 C--N 1.325 -0.472 0 CA-C-O 120.925 0.393 . . . . 0.0 110.569 179.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.714 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.916 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.714 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 89.9 mttt -89.38 -57.61 2.82 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 123.068 1.414 . . . . 0.0 108.843 -5.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -77.8 -27.39 50.11 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 112.873 -1.967 . . . . 0.0 111.655 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.0 -59.2 5.41 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.249 -0.58 . . . . 0.0 111.068 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.525 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.5 t80 -77.33 -36.01 54.27 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.919 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.4 ttt -57.26 -38.53 74.01 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.082 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.5 ttt -76.64 -42.8 40.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -57.0 -42.43 80.26 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.844 0.354 . . . . 0.0 110.249 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -72.52 -44.37 62.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.655 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.35 -31.84 66.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.83 179.652 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 121.054 0.454 . . . . 0.0 111.625 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.3 m -77.45 147.35 35.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.17 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.42 130.84 35.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 84.2 mt -114.98 142.35 46.75 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.226 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.513 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 37.3 m-85 -63.17 132.37 51.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.977 0.418 . . . . 0.0 110.388 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.47 -15.64 59.79 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.979 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -80.51 141.63 34.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.102 0.477 . . . . 0.0 111.568 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.02 127.32 33.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.132 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.0 pt -112.01 162.82 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.492 0.663 . . . . 0.0 112.761 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.401 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.9 tp -118.73 109.99 16.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.949 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -98.0 117.77 33.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.615 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.446 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.7 ttp-105 -104.08 116.15 31.7 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.45 ' HD1' ' H ' ' A' ' 126' ' ' SER . 29.2 t-80 -58.11 109.06 0.68 Allowed 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.409 ' OG ' HG22 ' A' ' 66' ' ' THR . 69.9 m -50.07 -54.13 22.43 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.423 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 46.7 t80 -57.54 -69.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.45 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 54.5 p -62.76 -29.39 70.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.73 -1.82 88.01 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.085 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 64.1 mtm -85.29 -165.69 1.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.193 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.468 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 59.0 m-85 -132.27 140.07 48.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 tp -55.03 128.46 33.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.8 t -137.97 147.7 44.51 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -176.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -94.58 97.98 10.5 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.497 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.2 mt -74.71 155.45 37.69 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.341 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -85.72 3.97 38.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.928 -178.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 64.2 p -92.2 123.72 35.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.649 0.262 . . . . 0.0 110.977 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.682 179.966 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . . . . . . 0 N--CA 1.449 -0.489 0 CA-C-O 121.493 0.664 . . . . 0.0 112.236 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.497 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 18.8 m-85 -101.81 173.03 6.59 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.963 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -90.98 141.99 28.25 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.7 117.68 55.71 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.346 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.84 -150.66 6.13 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.769 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 72.3 mt -114.39 148.43 37.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.902 0.382 . . . . 0.0 110.618 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -135.22 141.58 45.83 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.39 -58.7 3.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.71 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -82.64 151.69 26.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.883 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.7 p -107.33 -3.19 19.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.162 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.8 p -56.71 113.02 1.46 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.14 -159.02 22.23 Favored Glycine 0 N--CA 1.442 -0.965 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.517 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 42.1 mt-10 -120.63 -12.54 8.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.781 0.324 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.429 ' HA ' ' HG ' ' A' ' 187' ' ' SER . . . -57.87 -32.24 67.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.214 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.0 m -92.17 9.1 35.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -111.69 131.45 55.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.147 0.498 . . . . 0.0 111.408 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.436 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -126.47 117.52 23.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.775 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -79.07 126.4 30.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.101 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.1 pt -88.56 135.17 26.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.855 0.359 . . . . 0.0 111.009 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.462 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.6 m80 -127.25 151.58 74.8 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.149 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.632 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.5 Cg_endo -67.6 138.83 46.76 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.554 2.169 . . . . 0.0 112.275 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.72 -42.38 41.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.447 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 36.4 m -105.01 -173.09 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.416 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -95.41 6.92 47.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.475 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -86.23 -34.26 20.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.947 0.403 . . . . 0.0 110.792 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.632 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.4 mmp_? -86.78 146.52 26.21 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 33.9 t -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.429 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.84 129.08 38.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.253 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.24 -13.61 64.44 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.999 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.8 158.47 36.03 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.943 0.401 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -74.09 143.16 45.51 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 89.8 t -93.48 114.93 31.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.264 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -80.74 155.0 26.93 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 121.325 0.583 . . . . 0.0 111.709 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.84 122.82 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.54 -18.0 27.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.922 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -66.88 128.79 37.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.746 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.437 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.3 m-20 -72.99 116.54 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 61.7 mt -99.73 149.43 23.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -178.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.462 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 56.2 mt -114.31 112.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 176.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.71 137.61 32.21 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.177 0.513 . . . . 0.0 112.278 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.44 HG21 ' CD1' ' A' ' 191' ' ' TYR . 76.7 t -130.41 124.21 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.841 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 32.2 t -63.06 127.46 31.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 97.7 t -71.39 -32.26 46.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 120.896 0.379 . . . . 0.0 110.814 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' SER . . . . . 0.429 ' HG ' ' HA ' ' A' ' 157' ' ' ALA . 96.1 p -78.91 -39.42 34.87 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.482 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 55.1 m -114.06 4.91 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.32 31.15 1.7 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.301 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.32 144.18 42.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.93 0.395 . . . . 0.0 110.69 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.462 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.8 m-85 -74.15 152.57 39.81 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.406 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 41.3 tp -75.15 77.6 2.3 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -77.75 150.44 34.38 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -174.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.8 tp -100.1 119.16 37.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.532 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.3 t -113.01 147.19 37.69 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.55 90.17 3.25 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.09 -175.03 46.32 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.17 -1.014 . . . . 0.0 111.437 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 34.8 m-80 1.11 -78.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.368 0.667 . . . . 0.0 112.496 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 34.6 t -147.05 11.38 1.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 52.2 m -125.88 -178.97 4.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.982 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.415 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 93.3 m95 -107.2 135.6 48.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.21 0.528 . . . . 0.0 111.195 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.469 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 29.9 m-70 -127.23 174.73 8.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.79 130.07 66.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.283 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -147.05 172.31 13.93 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.606 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.26 92.31 5.38 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.61 179.64 4.02 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.562 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -88.11 11.38 16.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.298 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -119.6 137.65 53.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.697 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.31 175.58 1.28 Allowed 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 122.352 1.072 . . . . 0.0 112.997 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.8 m -169.36 119.84 0.69 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.794 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 39.6 mt -74.36 129.41 37.74 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.045 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.406 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.9 m95 -116.04 146.77 41.9 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.449 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -115.02 101.89 9.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.318 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.733 HG23 ' HG ' ' A' ' 22' ' ' LEU . 61.9 t -93.49 101.58 12.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.975 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.0 143.23 29.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.098 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.47 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.38 105.26 0.59 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.237 1.958 . . . . 0.0 111.366 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.7 mm . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.94 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.8 mt -80.11 122.47 26.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 178.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.2 mmm180 -111.71 158.05 19.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.186 0.517 . . . . 0.0 111.315 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.423 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -68.06 155.79 38.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.7 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 16' ' ' THR . 7.5 m-20 71.18 -3.46 2.06 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.841 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.407 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.74 138.35 46.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -84.74 119.39 25.22 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.441 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -135.83 170.54 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -177.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.558 HG11 HD13 ' A' ' 62' ' ' LEU . 3.4 m -131.66 135.91 58.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.267 176.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.689 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -97.04 123.06 40.67 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.519 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 38.2 mt-30 -120.2 164.83 15.63 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.275 0.56 . . . . 0.0 111.355 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -151.82 142.88 23.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.49 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -86.99 119.73 27.5 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.43 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.413 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -113.11 119.84 39.23 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.851 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.7 m -123.88 132.01 53.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 112.037 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.418 HG21 ' CD2' ' A' ' 29' ' ' HIS . 17.7 tt -168.9 148.94 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.446 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.418 ' CD2' HG21 ' A' ' 28' ' ' ILE . 47.7 m-70 58.23 42.0 22.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 59.82 23.21 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.28 179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -126.5 145.68 50.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.412 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -130.71 142.52 50.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.924 0.392 . . . . 0.0 111.2 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.458 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -153.9 171.55 18.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.853 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -120.39 138.18 53.9 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.419 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.5 mt -127.14 145.43 50.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.21 137.62 46.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.987 0.423 . . . . 0.0 110.549 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.503 ' HA ' HD21 ' A' ' 49' ' ' LEU . 32.4 tp -60.83 111.69 1.75 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.168 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -110.56 165.54 11.73 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.417 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.89 162.02 11.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.802 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.57 148.09 50.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.7 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.9 -0.57 89.77 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.737 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -112.22 158.02 20.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.841 0.353 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.36 -136.15 16.18 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.464 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 1.2 p30 -87.12 7.86 26.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.695 0.283 . . . . 0.0 110.877 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.87 28.84 0.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.323 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.8 mt -79.41 141.13 37.13 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.2 m -80.93 150.04 29.15 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.476 0.655 . . . . 0.0 111.245 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -144.14 -168.72 2.95 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.743 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 37' ' ' LEU . 22.7 mt -130.94 144.53 51.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.422 0.63 . . . . 0.0 112.361 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.2 mt-10 . . . . . 0 CA--C 1.503 -0.854 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.819 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.558 HD13 HG11 ' A' ' 21' ' ' VAL . 50.1 tp . . . . . 0 C--O 1.232 0.153 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.3 m -52.32 -46.52 66.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 26.3 pt -70.92 -20.34 21.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 57.1 m -97.71 13.02 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.072 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.414 HG21 ' OG ' ' A' ' 124' ' ' SER . 25.8 m -91.36 130.37 37.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.15 0.5 . . . . 0.0 111.91 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.06 161.53 35.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.108 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.66 133.34 69.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.609 178.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.404 HD11 ' HB2' ' A' ' 18' ' ' ASP . 17.1 mt -81.49 65.5 6.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.8 mm-40 -44.55 -60.23 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.2 mm-40 -126.42 163.67 22.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.706 0.765 . . . . 0.0 112.839 -177.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.6 t -155.43 84.06 1.05 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.476 -1.238 . . . . 0.0 108.999 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -111.73 152.65 27.52 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.33 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.4 t -65.4 148.55 51.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.4 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.1 t -50.44 -46.09 26.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.027 0.441 . . . . 0.0 110.288 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -55.55 -57.56 11.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.129 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.35 -44.76 84.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.177 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.8 -50.88 72.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.104 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 95.8 mt-30 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.629 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.709 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 31.8 mm-40 . . . . . 0 CA--C 1.533 0.317 0 CA-C-O 118.735 -0.65 . . . . 0.0 112.37 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.709 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 26.1 ttmt -86.64 -50.6 6.68 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.363 1.465 . . . . 0.0 111.487 -2.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 51.6 t-105 -54.86 -36.68 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.319 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 88.0 tttt -65.75 -32.82 74.58 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.771 -178.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.695 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -74.1 -49.37 24.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.999 0.428 . . . . 0.0 109.885 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 53.7 ttp -61.06 -37.94 84.42 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.763 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttp -73.41 -40.19 64.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.983 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -61.34 -45.21 95.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.788 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 48.9 p -70.85 -45.27 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.292 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.88 -31.08 72.05 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.257 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.973 -179.709 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 121.041 0.448 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.47 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 75.0 m -78.45 147.02 34.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.286 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.0 131.55 35.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.679 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 75.2 mt -115.29 143.39 45.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.046 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.446 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 36.2 m-85 -62.79 132.68 53.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.041 0.448 . . . . 0.0 110.554 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.91 -11.84 64.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.039 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.93 141.42 32.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.038 0.447 . . . . 0.0 111.267 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.87 127.42 33.48 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 160' ' ' TRP . 49.0 pt -111.41 161.87 9.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.565 0.698 . . . . 0.0 112.692 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 24.0 tp -117.74 108.25 15.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.809 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -96.37 116.85 29.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.832 -179.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.458 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 13.4 ttp-105 -102.94 116.26 32.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.671 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.481 ' HD1' ' H ' ' A' ' 126' ' ' SER . 30.2 t-80 -58.44 108.32 0.61 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.414 ' OG ' HG21 ' A' ' 66' ' ' THR . 58.6 m -49.71 -53.09 26.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.414 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.3 t80 -58.57 -69.7 0.18 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.481 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 54.8 p -64.99 -23.75 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.27 -1.92 83.5 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.309 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.2 mtt -81.56 -164.65 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.503 0.192 . . . . 0.0 110.644 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.44 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.9 m-85 -134.77 137.87 43.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.04 129.2 29.99 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -138.26 147.6 43.85 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.7 t -94.98 96.45 9.29 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.6 mt -71.44 156.66 39.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.574 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 45.7 t -83.13 -7.31 59.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.189 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 72.5 p -88.63 121.14 30.69 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.854 0.359 . . . . 0.0 111.23 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 28.6 t . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.617 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.438 0 CA-C-O 121.528 0.68 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 18.5 m-85 -100.01 171.01 8.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.04 177.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -89.37 144.05 26.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 76.6 t -113.4 117.07 54.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.0 -147.19 5.6 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.307 -0.949 . . . . 0.0 113.006 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.443 HD13 ' HG ' ' A' ' 126' ' ' SER . 57.7 mt -117.34 147.74 42.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.94 0.4 . . . . 0.0 111.074 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -136.05 142.95 44.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.742 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -75.4 -55.77 5.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.783 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.43 145.82 30.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 0.0 110.882 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.3 p -103.59 -8.04 20.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.994 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 69.0 p -55.09 109.95 0.6 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.408 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.65 -158.36 23.21 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.42 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -122.13 -13.39 8.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.704 0.288 . . . . 0.0 111.124 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.13 67.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.094 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.9 m -91.96 8.3 38.16 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.43 132.39 54.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.106 0.479 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.458 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.74 117.89 22.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.63 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.424 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 16.0 p -78.99 125.8 29.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.172 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.4 pt -87.83 136.45 23.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.851 0.357 . . . . 0.0 110.676 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.466 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.8 m80 -129.04 150.21 74.71 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.583 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.0 Cg_endo -67.17 138.72 48.14 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.205 . . . . 0.0 112.287 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.23 66.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 63.1 m -112.82 -167.78 1.23 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.176 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -91.59 -13.35 32.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.903 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.03 -35.71 81.13 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.997 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.583 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 75.9 mmt-85 -91.31 143.87 26.19 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 56.0 m -124.82 166.4 16.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.414 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.84 131.21 45.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.545 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.41 -14.88 64.27 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.082 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -68.77 154.71 41.48 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.947 0.403 . . . . 0.0 111.043 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -70.55 142.89 51.74 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.3 t -93.03 110.92 23.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.498 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 153.23 40.14 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 121.289 0.566 . . . . 0.0 111.363 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 16.5 t -69.66 120.88 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 176.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.25 -13.75 30.96 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.304 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -67.58 132.28 47.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.321 . . . . 0.0 111.001 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.1 m-20 -73.1 116.17 13.3 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.477 HD11 HG23 ' A' ' 214' ' ' VAL . 60.7 mt -101.43 148.83 24.71 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.676 0.751 . . . . 0.0 112.964 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.466 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.9 mt -113.53 113.81 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 176.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -93.6 137.28 33.03 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.112 0.482 . . . . 0.0 112.224 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.424 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 69.5 t -130.52 125.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.793 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.6 t -63.88 125.62 24.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.853 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 98.6 t -70.14 -30.81 45.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.88 0.372 . . . . 0.0 110.711 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.2 t -81.6 -33.78 31.32 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 69.9 m -120.77 10.16 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.484 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.3 31.19 0.36 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.484 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 27.4 mtt85 -112.2 142.66 44.41 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.089 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 58.8 m-85 -73.76 152.41 40.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 36.9 tp -74.76 75.99 2.08 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.462 ' HA ' ' HG1' ' A' ' 210' ' ' THR . 81.8 t60 -75.64 149.47 38.18 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -174.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.54 116.46 31.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.753 -1.567 . . . . 0.0 107.768 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 51.7 p -110.05 146.26 35.67 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -105.68 92.67 4.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -80.82 -174.84 49.03 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.435 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.1 m-80 0.66 -79.37 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.283 0.633 . . . . 0.0 112.409 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.8 p -146.61 12.2 1.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.98 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.7 p -125.94 -179.45 4.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.413 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 94.1 m95 -106.85 136.45 46.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.18 0.514 . . . . 0.0 111.196 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.454 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 26.6 m-70 -128.66 173.01 10.68 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.009 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.02 136.43 60.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.231 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.415 ' OD1' ' HB3' ' A' ' 206' ' ' ALA . 2.8 p30 -154.0 172.24 17.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.572 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.476 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -99.15 95.2 6.93 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.095 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.415 ' HB3' ' OD1' ' A' ' 204' ' ' ASP . . . -113.72 -179.4 3.63 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.321 -177.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -88.67 8.59 27.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.178 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 47.2 mt-30 -116.02 138.19 51.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.769 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.62 175.63 2.26 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.319 1.057 . . . . 0.0 113.242 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.462 ' HG1' ' HA ' ' A' ' 193' ' ' HIS . 24.0 m -170.04 121.3 0.65 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.954 -1.93 . . . . 0.0 107.67 178.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 46.2 mt -74.68 131.42 40.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.798 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.456 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.3 m95 -118.89 127.48 53.53 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.344 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.5 t -93.16 101.45 13.74 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.318 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.689 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.9 t -93.86 102.5 13.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.663 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.18 142.03 27.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.335 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.4 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.6 Cg_exo -63.28 103.93 0.39 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.14 1.893 . . . . 0.0 111.098 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.449 HD13 ' HA ' ' A' ' 217' ' ' ILE . 4.3 mm . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.299 -179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 . . . . . 0 CA--C 1.517 -0.29 0 CA-C-O 120.778 0.323 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.7 mt -79.95 122.91 27.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.404 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.5 mmm180 -110.67 157.23 19.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.105 0.479 . . . . 0.0 111.257 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.4 p -67.64 157.19 35.07 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.828 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 69.16 -2.2 1.89 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.793 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.0 m-20 -73.95 139.81 45.13 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.443 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -84.0 118.13 23.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.444 HG12 HD13 ' A' ' 69' ' ' LEU . 17.3 m -135.52 169.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.649 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -131.96 141.0 46.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 108.388 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.66 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.8 mp -100.76 120.82 40.66 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.571 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -122.19 148.58 44.77 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.698 0.761 . . . . 0.0 112.323 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.437 ' HG ' ' N ' ' A' ' 25' ' ' THR . 27.1 t -136.45 147.45 47.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.492 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.437 ' N ' ' HG ' ' A' ' 24' ' ' CYS . 25.0 m -88.99 123.49 33.36 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.552 179.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.436 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -114.42 120.86 41.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.094 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 m -126.51 133.32 51.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.766 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.409 HG21 ' CD2' ' A' ' 29' ' ' HIS . 18.4 tt -170.4 148.59 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.499 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.409 ' CD2' HG21 ' A' ' 28' ' ' ILE . 48.4 m-70 58.4 40.26 24.42 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.908 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.518 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.05 22.16 12.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.594 179.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -126.21 145.75 50.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.456 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -131.12 149.02 52.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.905 0.383 . . . . 0.0 111.196 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -161.6 169.58 21.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -116.42 138.22 51.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.526 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.6 mt -128.06 139.44 52.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.705 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.596 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 48.0 t -104.61 142.63 34.31 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.632 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.466 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.3 tp -62.27 114.85 3.71 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.751 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.403 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.67 165.04 13.22 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.5 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.56 166.27 10.1 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.715 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.59 145.75 38.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.616 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.16 17.34 33.43 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.198 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -123.44 150.27 44.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.852 0.358 . . . . 0.0 110.621 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.18 -135.8 15.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.493 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -85.12 8.7 17.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.689 0.28 . . . . 0.0 111.083 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.52 29.24 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.293 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -77.26 139.33 39.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.019 0.438 . . . . 0.0 110.546 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.3 m -81.12 151.18 28.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.593 0.711 . . . . 0.0 111.119 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -144.85 -165.65 2.21 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.61 178.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.8 mt -130.64 140.7 50.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.386 0.613 . . . . 0.0 112.083 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.504 -0.802 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.59 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.595 HD12 HG12 ' A' ' 21' ' ' VAL . 45.5 tp . . . . . 0 C--O 1.231 0.113 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.2 m -46.72 -55.76 7.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 26.9 pt -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.649 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.48 -3.27 43.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 0.0 111.262 -179.363 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.8 m -83.72 134.55 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.271 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.87 164.85 27.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.02 133.64 65.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.817 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.444 HD13 HG12 ' A' ' 20' ' ' VAL . 14.7 mt -82.85 65.01 7.76 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.3 mm-40 -44.55 -59.66 2.35 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -125.93 164.19 21.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.682 0.753 . . . . 0.0 112.897 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -156.18 84.77 1.0 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.993 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.0 mt -111.84 157.92 20.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.457 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -71.64 147.87 47.09 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.6 t -49.55 -44.12 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.095 0.474 . . . . 0.0 110.247 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -58.83 -50.08 75.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.98 97.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.828 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.81 -44.19 96.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.157 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 120.884 0.373 . . . . 0.0 110.462 179.805 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.737 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 20.9 mm-40 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.816 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.737 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 32.3 mtmm -86.61 -51.11 6.35 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 120.251 1.387 . . . . 0.0 111.326 -2.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -55.87 -40.52 73.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.847 -1.524 . . . . 0.0 112.881 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.562 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 20.8 tptm -58.18 -34.42 70.33 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.206 -179.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.711 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.0 t80 -73.44 -44.73 57.53 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 15.9 tpt -57.77 -34.37 69.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.216 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.5 mtp -73.22 -49.86 25.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -59.84 -34.69 73.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.646 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.9 m -72.65 -46.86 51.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.913 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.67 71.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.744 179.709 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 13.3 ptp180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.974 0.416 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.404 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 88.8 m -70.8 148.16 48.17 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.094 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 mp -82.19 131.33 35.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.514 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 74.5 mt -116.37 141.85 47.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.387 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.538 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 39.8 m-85 -61.36 131.86 51.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.495 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.21 -10.37 61.62 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.178 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -85.83 140.24 30.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.072 0.463 . . . . 0.0 111.365 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.439 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.88 127.53 33.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.3 pt -111.91 161.77 10.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.521 0.677 . . . . 0.0 112.732 -178.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 22.7 tp -117.49 109.31 16.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.885 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -96.67 118.11 32.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.768 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.432 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.6 ttp-105 -104.28 116.46 32.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.454 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.8 t-80 -58.82 107.44 0.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.3 t -49.79 -49.95 46.63 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -177.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 51.8 t80 -61.09 -67.25 0.42 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.429 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 56.0 p -68.22 -20.38 64.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.97 -0.85 71.02 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.252 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -82.67 -164.62 0.88 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.485 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.8 m-85 -133.95 138.26 45.36 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.6 tp -54.05 127.89 28.36 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.541 ' HG ' HD22 ' A' ' 133' ' ' LEU . 51.8 t -136.69 149.86 48.14 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -97.52 99.09 10.48 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.541 HD22 ' HG ' ' A' ' 131' ' ' CYS . 11.8 mt -75.9 153.5 36.66 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 54.4 m -84.01 9.95 11.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.954 -178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.2 p -94.03 124.81 38.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.84 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.394 0 CA-C-O 121.386 0.612 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.528 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.0 m-85 -100.17 170.38 8.5 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.276 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -89.26 144.3 26.2 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -113.63 117.6 55.9 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.348 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.5 -147.08 5.52 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.899 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 59.0 mt -117.42 151.28 37.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.893 0.378 . . . . 0.0 110.774 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -141.69 142.97 33.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.886 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.54 -64.11 1.1 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.566 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -73.46 145.11 45.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.664 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 60.2 p -104.05 -5.13 22.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.947 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.3 p -54.71 111.84 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.527 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.84 -160.56 22.84 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.485 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.417 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -118.53 -12.29 9.81 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.803 0.335 . . . . 0.0 111.234 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.49 66.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 77.9 m -94.55 10.86 33.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -111.8 131.64 55.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.57 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.455 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.0 m95 -127.22 116.64 20.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.662 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 8.0 p -79.25 128.6 33.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.188 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.0 pt -89.81 135.59 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 0.0 110.842 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.441 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.0 m80 -127.8 150.23 72.74 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.186 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.658 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.91 137.08 43.72 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.504 2.136 . . . . 0.0 112.297 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.01 -45.79 59.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.752 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.435 ' HB2' ' NE2' ' A' ' 168' ' ' GLN . 85.3 p -108.53 -175.59 2.82 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.262 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.74 14.83 14.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.139 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.435 ' NE2' ' HB2' ' A' ' 166' ' ' SER . 2.6 mp0 -88.21 -33.06 18.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.658 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.4 mmp_? -92.46 146.76 23.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.069 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 32.0 t -125.1 165.76 17.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.278 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.83 131.63 46.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.95 -16.43 60.91 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.049 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.1 mt-10 -67.49 155.08 39.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.042 0.448 . . . . 0.0 111.205 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -71.16 142.68 50.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.602 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.413 HG13 HD22 ' A' ' 181' ' ' LEU . 95.4 t -93.74 112.0 25.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.148 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . 0.436 ' HD2' ' N ' ' A' ' 176' ' ' ARG . 1.2 mpt_? -78.58 154.83 30.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-O 121.388 0.614 . . . . 0.0 111.611 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 55.2 t -69.05 122.72 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.25 -12.69 36.93 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.076 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.26 126.29 29.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.787 0.327 . . . . 0.0 110.796 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 18.9 m-20 -69.49 114.77 8.03 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.413 HD22 HG13 ' A' ' 175' ' ' VAL . 60.4 mt -100.44 151.84 21.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.788 0.804 . . . . 0.0 112.998 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 57.2 mt -115.75 113.74 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.8 mp -93.48 135.32 34.84 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.201 0.525 . . . . 0.0 112.189 -178.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.411 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.1 t -127.35 126.66 68.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.739 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.4 t -67.03 124.18 22.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 98.4 t -68.64 -32.72 56.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.946 0.403 . . . . 0.0 110.968 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.2 t -78.0 -37.62 46.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 p -117.63 7.76 12.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 46.34 31.95 1.4 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 36.1 mtt85 -112.42 142.3 45.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.842 0.353 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.483 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 63.6 m-85 -74.31 154.04 39.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.4 tp -76.09 76.95 2.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.404 -2.072 . . . . 0.0 105.404 175.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.429 ' HA ' ' HG1' ' A' ' 210' ' ' THR . 81.3 t60 -76.89 150.23 36.03 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.436 HD23 ' SG ' ' A' ' 24' ' ' CYS . 13.4 tp -99.84 115.88 30.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 113.763 -1.562 . . . . 0.0 107.656 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 68.3 m -109.65 145.66 36.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -103.4 96.98 7.11 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 177.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.542 ' HA3' ' NE2' ' A' ' 202' ' ' HIS . . . -76.73 -167.03 25.67 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.04 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.461 ' C ' ' O ' ' A' ' 197' ' ' GLY . 4.4 p-10 -18.92 -63.03 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' SER . . . . . 0.442 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 86.3 p -154.7 11.59 0.37 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.217 0.532 . . . . 0.0 109.612 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.1 t -127.04 179.02 5.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.832 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 92.5 m95 -106.24 135.76 47.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.297 0.57 . . . . 0.0 111.27 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.542 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 15.1 m-70 -128.45 174.02 9.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.863 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -128.14 132.43 68.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.308 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -149.82 168.0 24.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.662 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -94.7 96.79 9.63 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.75 179.45 3.95 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.386 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -87.2 8.41 24.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.186 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -117.23 136.68 52.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.724 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -65.23 174.7 1.94 Allowed 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 122.364 1.078 . . . . 0.0 113.007 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.429 ' HG1' ' HA ' ' A' ' 193' ' ' HIS . 27.7 m -166.71 121.54 1.11 Allowed 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.99 -1.914 . . . . 0.0 107.798 178.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 51.2 mt -75.23 128.74 36.14 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.035 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.2 m95 -116.27 145.32 43.24 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.611 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 39.2 t -113.04 101.29 9.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.278 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.66 HG23 ' HG ' ' A' ' 22' ' ' LEU . 92.5 t -92.61 102.19 13.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.918 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.24 142.36 27.89 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.194 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.476 ' O ' HG12 ' A' ' 217' ' ' ILE . 22.8 Cg_exo -64.8 105.26 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.252 1.968 . . . . 0.0 111.484 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 216' ' ' PRO . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.833 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 . . . . . 0 CA--C 1.517 -0.312 0 CA-C-O 120.898 0.38 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.4 mt -78.55 124.35 28.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -112.1 157.47 20.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.07 0.462 . . . . 0.0 110.952 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.423 ' HG1' ' H ' ' A' ' 111' ' ' ARG . 9.2 p -67.64 155.38 39.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.863 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 71.02 -3.36 2.05 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.874 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -72.58 134.7 45.32 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.51 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -80.58 119.39 23.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.514 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.6 m -136.18 171.14 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.625 0.726 . . . . 0.0 112.948 -177.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.8 m -133.73 137.15 53.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.271 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.67 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.1 mp -97.73 121.77 40.04 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.613 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.441 ' HB2' ' OG ' ' A' ' 213' ' ' SER . 80.3 mt-30 -121.34 156.0 33.54 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.352 0.596 . . . . 0.0 111.538 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.451 ' HG ' HD21 ' A' ' 194' ' ' LEU . 21.5 t -143.7 144.48 31.88 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.368 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -86.14 124.98 33.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.445 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.441 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -116.36 119.53 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.034 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.2 m -122.46 139.38 53.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.781 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.2 tt -178.38 144.55 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.671 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.1 m80 59.11 41.15 21.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.318 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.3 20.98 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.626 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -127.81 134.28 49.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 110.672 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -124.02 146.22 48.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.056 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -156.21 171.62 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.857 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -117.87 136.37 53.5 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.464 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.07 143.02 51.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.44 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.597 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 50.9 t -107.64 142.67 37.24 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.649 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.455 ' HA ' HD22 ' A' ' 49' ' ' LEU . 30.3 tp -62.35 114.51 3.53 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.72 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -114.48 164.28 14.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.434 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 166.79 10.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.686 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.23 151.26 47.5 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.687 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.12 -6.92 87.66 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.624 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -107.82 163.07 13.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.11 -142.03 25.82 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.401 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.2 p30 -84.09 9.68 11.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 110.622 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.61 29.28 0.4 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.949 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.4 mt -79.37 139.17 37.82 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.97 0.414 . . . . 0.0 110.621 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.6 m -80.25 149.84 30.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.545 0.688 . . . . 0.0 111.131 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -144.17 -166.97 2.49 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.591 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.4 mt -129.79 141.43 50.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.336 0.588 . . . . 0.0 112.266 -178.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.43 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 mt-10 . . . . . 0 CA--C 1.502 -0.87 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.755 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.556 HD13 HG13 ' A' ' 21' ' ' VAL . 44.6 tp . . . . . 0 C--O 1.232 0.149 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.9 m -47.62 -54.88 10.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.0 pt -68.54 -16.9 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.01 -0.39 47.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.075 0.464 . . . . 0.0 111.305 -179.183 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.3 m -85.27 134.12 34.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.349 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -138.27 162.5 34.18 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.101 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.511 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.8 134.57 65.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.71 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.25 64.93 8.01 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 9.8 mm-40 -44.25 -62.9 1.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -122.91 163.08 21.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.705 0.764 . . . . 0.0 112.897 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -155.34 85.08 1.06 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.478 -1.237 . . . . 0.0 108.951 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.33 158.14 20.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.8 p -71.13 146.83 48.95 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.1 t -49.92 -45.72 22.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.083 0.468 . . . . 0.0 110.195 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.2 ttp85 -55.44 -54.24 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.454 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.31 95.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.821 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.4 tp -59.06 -44.55 91.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.281 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 97.1 mt-30 . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.791 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 3.2 mm-40 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.789 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.791 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 54.0 pttt -87.5 -50.98 6.18 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 120.372 1.442 . . . . 0.0 111.691 -3.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.403 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.7 p-90 -63.99 -28.8 70.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.948 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -61.8 -41.66 98.02 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.776 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.691 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.3 t80 -74.18 -45.17 50.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.123 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.4 ttp -56.57 -42.86 79.32 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.653 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.2 mmt -73.55 -40.07 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.163 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.51 -45.8 84.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.891 0.377 . . . . 0.0 110.626 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' THR . . . . . 0.434 ' HG1' ' H ' ' A' ' 105' ' ' ALA . 52.4 p -70.09 -47.05 63.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.893 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.434 ' H ' ' HG1' ' A' ' 104' ' ' THR . . . -62.08 -23.53 66.57 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.09 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.817 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.423 ' H ' ' HG1' ' A' ' 16' ' ' THR . 13.0 ptp180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.01 0.433 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.45 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 63.1 m -71.64 147.23 47.72 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.255 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.63 131.39 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.424 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.5 mt -115.58 141.58 47.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.291 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.47 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.9 m-85 -61.98 129.58 41.58 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.983 0.42 . . . . 0.0 110.491 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.78 -13.14 57.88 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.051 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.49 140.89 33.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.04 0.448 . . . . 0.0 111.324 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.12 126.25 31.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.6 pt -112.06 158.26 12.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.527 0.679 . . . . 0.0 112.77 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.6 tp -114.26 109.97 19.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.966 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.0 116.48 29.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.688 -179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.511 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.9 ttp85 -102.85 117.11 33.91 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.795 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.482 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.1 t-80 -59.72 108.58 0.76 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.0 t -53.02 -45.31 67.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.482 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 53.7 t80 -65.16 -57.56 8.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.21 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.435 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 57.8 p -79.82 -15.39 57.51 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.63 -0.49 56.03 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.432 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.6 mtt -83.23 -165.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.466 0.175 . . . . 0.0 110.566 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.476 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 70.4 m-85 -134.09 138.11 45.06 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.97 125.62 21.11 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.426 ' HG ' ' HG ' ' A' ' 158' ' ' CYS . 40.7 t -134.37 146.92 50.36 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . 0.44 ' HB2' ' HG ' ' A' ' 185' ' ' SER . 49.7 t -93.6 97.18 10.32 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.468 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -73.66 153.26 40.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.467 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.0 t -83.6 2.88 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.814 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 50.2 p -89.79 122.49 32.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.771 0.319 . . . . 0.0 110.909 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 57.5 m . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.747 179.815 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.448 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.7 m-85 -104.45 177.06 4.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.425 -1.261 . . . . 0.0 108.692 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -94.18 141.62 28.34 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 65.4 t -112.43 116.98 54.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.32 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.39 -147.9 5.8 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.758 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.1 mt -116.74 151.89 35.46 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.87 0.366 . . . . 0.0 110.58 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.23 136.08 31.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.805 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -69.45 -46.84 65.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.15 147.75 25.48 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.754 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.4 p -107.03 -7.6 16.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.6 p -53.87 116.78 2.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.502 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.21 -161.52 19.69 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.686 -0.769 . . . . 0.0 111.495 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.448 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.3 mt-10 -118.34 -15.19 9.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.741 0.305 . . . . 0.0 111.271 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.3 -32.17 68.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.126 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . 0.426 ' HG ' ' HG ' ' A' ' 131' ' ' CYS . 78.3 m -88.15 4.5 45.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.478 -179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -109.8 135.35 50.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.044 0.449 . . . . 0.0 111.207 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.415 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.0 m95 -128.74 116.57 19.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.604 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.8 p -78.59 124.6 28.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 pt -87.16 136.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.828 0.347 . . . . 0.0 110.936 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.424 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.06 150.03 72.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.563 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.8 Cg_endo -66.26 138.22 50.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.497 2.131 . . . . 0.0 112.483 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.18 -43.39 52.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.581 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 50.4 m -105.1 -170.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.286 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -92.44 -12.53 31.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -67.38 -35.48 79.41 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.318 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.563 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.2 mmt-85 -87.47 146.04 26.01 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.3 t -128.68 168.22 16.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.899 0.38 . . . . 0.0 111.411 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.71 132.28 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.151 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.56 -14.63 64.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.947 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -70.75 155.7 40.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.011 0.434 . . . . 0.0 111.258 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -71.53 144.13 49.71 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.48 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.406 HG11 HD23 ' A' ' 181' ' ' LEU . 80.0 t -94.84 111.14 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.409 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.89 154.54 35.95 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.399 0.618 . . . . 0.0 111.572 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.48 123.0 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.326 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -18.21 30.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -63.95 130.3 43.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.721 0.296 . . . . 0.0 110.739 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.605 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -72.34 115.31 11.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.406 HD23 HG11 ' A' ' 175' ' ' VAL . 66.8 mt -99.5 147.37 25.37 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.745 0.783 . . . . 0.0 112.911 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.424 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 58.4 mt -112.81 112.29 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.47 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.6 mp -92.49 136.67 33.01 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.943 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.42 HG21 ' CD1' ' A' ' 191' ' ' TYR . 83.4 t -130.46 125.51 59.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.793 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' SER . . . . . 0.44 ' HG ' ' HB2' ' A' ' 132' ' ' CYS . 17.9 m -61.2 129.0 39.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.448 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.3 t -72.54 -32.48 41.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.548 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 42.4 t -79.93 -37.28 34.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.532 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 50.5 m -114.07 0.5 14.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.18 27.59 3.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 179.466 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -108.14 142.41 38.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.03 0.443 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.2 m-85 -72.95 153.14 41.09 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.0 tp -75.76 74.86 2.73 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -74.2 150.17 40.5 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -174.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.451 HD21 ' HG ' ' A' ' 24' ' ' CYS . 12.5 tp -99.82 116.22 31.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.522 176.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.3 t -110.05 147.8 32.9 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -107.64 89.76 3.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.75 -174.94 45.43 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.361 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 22.6 m-80 1.75 -79.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.435 0.694 . . . . 0.0 112.401 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 38.8 t -146.95 11.56 1.07 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.0 t -125.45 -179.17 4.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.752 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.441 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.3 m95 -107.24 136.08 47.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.27 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.459 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 27.9 m-70 -127.9 173.29 10.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.007 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.8 p -127.75 131.63 69.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.103 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.2 173.45 12.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.809 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.04 91.36 4.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.165 178.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.89 -179.82 3.91 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -88.18 7.7 30.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.214 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -116.51 137.33 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.608 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -64.73 175.44 1.46 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.399 1.095 . . . . 0.0 113.287 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -169.71 120.78 0.68 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.895 -1.957 . . . . 0.0 107.842 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 42.0 mt -74.47 132.8 42.21 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.937 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.414 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.9 m95 -121.31 118.24 29.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.489 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 213' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 23' ' ' GLN . 33.7 p -85.4 101.44 12.6 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.059 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.67 HG23 ' HG ' ' A' ' 22' ' ' LEU . 84.6 t -92.78 104.81 16.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.86 139.42 23.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.249 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.434 ' O ' HG12 ' A' ' 217' ' ' ILE . 33.1 Cg_exo -62.16 105.81 0.42 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.09 1.86 . . . . 0.0 111.266 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.514 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.156 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 120.791 0.329 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.3 mt -76.64 128.32 34.48 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 9.7 mmt85 -116.53 157.78 24.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.328 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.432 ' C ' ' H ' ' A' ' 18' ' ' ASP . 10.7 p -68.29 155.51 39.59 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.748 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.93 -8.26 1.31 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.0 m-20 -69.15 143.02 54.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 15.3 tt0 -89.57 116.29 27.61 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.487 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -132.54 175.65 10.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -135.15 142.03 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.575 176.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.699 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.8 mp -103.53 117.91 35.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.405 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 42.5 mt-30 -118.97 149.94 40.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.674 0.75 . . . . 0.0 112.458 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.1 p -137.26 142.59 41.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.558 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.9 m -84.85 121.97 28.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.475 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.452 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -112.77 120.07 40.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.095 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 m -125.46 134.16 52.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.539 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -170.77 145.43 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.486 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.5 m80 58.26 39.12 25.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.793 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.481 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 61.45 25.61 15.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.258 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -127.33 133.47 50.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.282 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -122.64 148.71 44.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.474 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -161.85 173.1 15.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.553 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -120.53 136.54 54.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.569 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -125.78 141.03 52.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.533 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.627 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 51.4 t -104.75 146.23 29.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.491 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.453 ' HA ' HD21 ' A' ' 49' ' ' LEU . 31.9 tp -65.34 112.6 3.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.943 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB3' HD13 ' A' ' 64' ' ' ILE . . . -111.51 163.8 13.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.571 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.4 164.92 10.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.703 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.07 143.53 42.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.69 179.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.22 18.73 21.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.277 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -124.72 147.55 48.56 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.42 -138.75 20.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.485 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -80.51 7.56 9.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.734 0.302 . . . . 0.0 110.787 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.44 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.77 32.44 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.095 179.619 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -78.08 137.61 38.32 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 110.449 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -78.85 150.81 32.15 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.583 0.706 . . . . 0.0 111.449 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 p90 -145.21 -166.28 2.38 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.488 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.8 mt -129.09 142.51 50.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.403 0.62 . . . . 0.0 112.096 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 tt0 . . . . . 0 CA--C 1.503 -0.854 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.797 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.587 HD12 HG12 ' A' ' 21' ' ' VAL . 46.1 tp . . . . . 0 C--O 1.23 0.065 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.1 m -46.69 -54.0 10.53 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.455 HD13 ' HB3' ' A' ' 38' ' ' ALA . 29.9 pt -69.01 -18.71 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.87 -2.21 47.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.068 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.4 m -84.7 133.01 34.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.387 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.88 162.69 33.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -126.42 133.64 68.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.786 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 18' ' ' ASP . 15.0 mt -82.69 65.4 7.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.49 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 8.8 mm-40 -45.01 -61.22 1.71 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -124.57 164.66 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.651 0.739 . . . . 0.0 112.796 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.507 ' HG ' HG22 ' A' ' 119' ' ' ILE . 57.1 m -157.47 86.73 0.94 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.03 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.17 154.84 28.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.271 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.7 t -68.55 150.49 47.97 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -51.82 -43.51 34.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.078 0.466 . . . . 0.0 110.162 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.405 ' HB3' ' NH1' ' A' ' 76' ' ' ARG . 18.4 ttp-105 -56.58 -57.13 13.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.912 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.61 89.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.091 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.6 tp -61.83 -46.49 89.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.256 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--N 1.324 -0.53 0 CA-C-O 120.958 0.409 . . . . 0.0 110.488 179.778 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.723 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.0 mm-40 . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 118.666 -0.683 . . . . 0.0 112.635 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.717 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 27.3 tttm -86.32 -50.86 6.62 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 125.469 1.508 . . . . 0.0 111.641 -2.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -57.53 -35.52 70.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.041 -1.436 . . . . 0.0 113.264 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 12.8 mmmm -64.18 -33.77 76.56 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.45 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.723 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 7.7 t80 -74.17 -49.43 23.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.224 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 50.0 ttm -59.45 -44.32 92.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.219 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.4 ttt -70.15 -49.25 52.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.534 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.8 -38.4 75.45 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.047 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 -46.77 57.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.83 -54.35 48.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.572 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.087 -179.648 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 . . . . . 0 N--CA 1.458 -0.068 0 CA-C-O 120.886 0.374 . . . . 0.0 111.019 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 84.4 m -78.98 144.28 34.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.411 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.09 130.39 35.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.4 mt -115.15 142.36 46.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.332 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.11 130.74 46.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.044 0.45 . . . . 0.0 110.529 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.6 -13.04 59.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.069 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -83.05 140.02 32.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.022 0.439 . . . . 0.0 111.456 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.99 128.18 33.82 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.507 HG22 ' HG ' ' A' ' 72' ' ' SER . 44.5 pt -112.65 159.72 12.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.649 0.738 . . . . 0.0 112.935 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.4 tp -115.66 107.19 14.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.686 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.1 mt -95.37 117.62 30.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.74 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.492 ' NH2' HG21 ' A' ' 68' ' ' VAL . 62.3 ttp85 -104.04 116.04 31.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.696 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.449 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.6 t-80 -57.69 110.71 0.94 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.9 t -52.76 -52.46 56.42 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.449 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 48.6 t80 -57.73 -66.9 0.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.449 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 60.0 p -66.72 -33.06 74.81 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.02 -3.11 80.44 Favored Glycine 0 C--N 1.322 -0.204 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.676 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.402 ' H ' ' HG ' ' A' ' 126' ' ' SER . 48.3 mtt -81.94 -165.5 1.0 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.716 -0.242 . . . . 0.0 110.434 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.49 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.7 m-85 -133.46 139.25 46.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.404 HD11 HD22 ' A' ' 37' ' ' LEU . 26.0 tp -54.66 127.14 26.77 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.485 ' HG ' HD22 ' A' ' 133' ' ' LEU . 52.8 t -136.5 143.99 44.07 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -91.82 97.83 11.23 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.5 mt -73.76 145.31 45.18 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.522 -178.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.5 p -76.71 -0.04 22.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.757 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.6 p -91.25 120.44 32.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 110.94 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 49.4 m . . . . . 0 C--N 1.324 -0.523 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.779 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.516 0.674 . . . . 0.0 112.139 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.516 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 14.5 m-85 -103.85 172.72 6.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.995 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.26 144.63 25.67 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 120.995 0.426 . . . . 0.0 109.867 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 74.8 t -114.13 117.9 56.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.288 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.84 -150.44 5.81 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.008 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 65.7 mt -114.89 151.96 33.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.925 0.393 . . . . 0.0 110.776 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -140.14 142.76 35.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.859 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.61 -51.62 11.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.529 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -83.27 146.25 28.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.0 p -106.54 -7.72 17.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 65.8 p -54.73 114.07 1.56 Allowed 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.49 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.06 -160.06 21.84 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.706 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.417 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.6 mt-10 -118.85 -14.85 9.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.745 0.307 . . . . 0.0 111.429 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.3 -34.35 66.41 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.4 m -89.51 8.01 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -111.02 133.51 53.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.104 0.478 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.425 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.3 m95 -128.13 115.98 19.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.741 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 13.5 p -78.35 126.36 30.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.208 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.3 pt -88.38 136.18 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -129.25 151.47 77.84 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.187 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.635 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.67 140.16 55.47 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.593 2.195 . . . . 0.0 112.397 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.73 51.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.746 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 7.7 t -110.79 -168.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.441 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -95.57 4.75 52.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.333 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -84.04 -30.65 25.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.905 0.383 . . . . 0.0 111.004 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.635 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.0 mmt-85 -92.27 144.23 25.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.7 m -124.94 164.79 19.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.935 0.397 . . . . 0.0 111.64 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 130.64 43.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.317 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.7 -16.95 60.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.027 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -67.79 156.18 37.62 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.952 0.406 . . . . 0.0 111.093 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -72.23 144.67 48.37 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.448 HG12 HD22 ' A' ' 181' ' ' LEU . 95.5 t -94.68 113.23 28.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -77.0 155.0 32.91 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.649 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 22.8 t -69.93 119.91 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.94 -13.76 31.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.309 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -66.38 132.48 48.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.813 0.339 . . . . 0.0 110.932 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.2 m-20 -73.49 110.46 7.8 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.747 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.467 HD12 HG21 ' A' ' 214' ' ' VAL . 56.6 mt -97.34 150.64 20.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.748 0.785 . . . . 0.0 112.985 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.488 HD12 ' NE2' ' A' ' 209' ' ' GLN . 48.0 mt -115.61 113.07 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 176.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.64 136.37 33.28 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.028 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.423 HG21 ' CD1' ' A' ' 191' ' ' TYR . 76.1 t -128.47 127.61 67.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.812 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 6.6 m -65.3 125.08 23.95 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.1 t -69.54 -30.36 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.963 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 94.1 p -79.94 -37.0 35.42 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.417 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 73.9 p -120.2 9.31 11.06 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 46.26 31.96 1.37 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.386 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.41 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 24.2 mtt180 -111.05 140.42 45.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.085 0.469 . . . . 0.0 110.983 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.487 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.5 m-85 -72.84 153.61 40.98 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.6 tp -75.57 75.93 2.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 175.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.26 151.07 38.41 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 115.68 1.734 . . . . 0.0 115.68 -174.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.2 tp -100.42 117.45 34.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.585 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 34.1 t -112.03 146.03 38.63 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -105.32 92.67 4.3 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.531 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -173.85 44.76 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.375 -0.916 . . . . 0.0 111.419 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.531 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.1 m120 -3.28 -76.3 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.362 0.665 . . . . 0.0 112.51 -179.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 78.2 p -147.7 13.72 1.05 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.116 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.1 t -128.42 179.45 5.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.452 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.9 m95 -106.07 136.45 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.219 0.533 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.462 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 23.0 m-70 -128.19 173.11 10.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.029 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.7 p -127.57 131.06 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.146 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -147.52 173.11 12.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.683 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.22 93.91 5.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.152 178.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -112.98 176.86 4.84 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.304 -177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -85.69 10.11 14.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.072 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -118.09 134.59 54.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.488 ' NE2' HD12 ' A' ' 182' ' ' ILE . 95.4 mt-30 -63.62 174.7 1.27 Allowed 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 122.389 1.09 . . . . 0.0 113.133 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.4 m -167.52 120.82 0.94 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.939 -1.937 . . . . 0.0 107.734 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.6 mt -74.53 128.76 36.34 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.004 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.419 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.3 m95 -115.78 147.31 41.1 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.498 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.3 t -113.62 98.57 7.14 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.326 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.699 HG23 ' HG ' ' A' ' 22' ' ' LEU . 99.1 t -91.63 100.45 11.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -117.6 135.79 23.39 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.478 ' HA ' HG13 ' A' ' 20' ' ' VAL . 17.5 Cg_endo -60.07 107.14 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 121.835 1.69 . . . . 0.0 111.135 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.487 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.6 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.121 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 . . . . . 0 CA--C 1.515 -0.385 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.4 mt -80.53 121.94 26.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.493 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -110.96 157.89 19.39 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.09 0.472 . . . . 0.0 111.287 -179.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 p -67.62 156.2 37.38 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.661 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 71.58 -4.25 1.93 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.818 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.402 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.9 m-20 -73.15 133.01 43.94 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.691 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.84 121.36 25.86 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.7 m -136.93 173.93 12.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.602 HG11 HD13 ' A' ' 62' ' ' LEU . 3.4 m -135.62 136.76 50.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.251 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.705 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.6 mp -97.49 122.92 41.1 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.672 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.439 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 38.6 mt-30 -122.84 149.29 44.37 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 112.029 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.507 ' HG ' HD12 ' A' ' 194' ' ' LEU . 26.4 p -136.18 144.07 44.76 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.627 178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.4 m -86.72 122.06 30.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.431 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -113.04 120.51 41.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.065 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.8 m -124.15 132.29 53.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.039 0.447 . . . . 0.0 111.761 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.46 HG23 ' HD1' ' A' ' 29' ' ' HIS . 17.1 tt -169.3 146.0 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.507 179.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.46 ' HD1' HG23 ' A' ' 28' ' ' ILE . 54.5 m80 59.79 39.66 20.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.074 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.7 mppt? 61.3 21.52 12.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.372 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -124.94 144.66 50.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -131.5 146.33 52.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.978 0.418 . . . . 0.0 111.384 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' ' 33' ' ' GLN . 2.2 pt20 -157.38 170.25 22.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.604 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -118.42 137.25 53.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.569 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 23' ' ' GLN . 1.4 mt -125.71 143.68 50.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.601 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.4 p -107.94 139.72 42.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 0.0 110.435 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HA ' HD22 ' A' ' 49' ' ' LEU . 34.4 tp -60.23 109.81 1.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.008 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HB2' HD11 ' A' ' 64' ' ' ILE . . . -109.06 164.34 12.51 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.6 -179.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.16 162.03 10.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.766 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.95 142.83 44.63 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.557 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.22 23.17 8.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.366 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -130.57 147.12 52.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.872 0.367 . . . . 0.0 110.561 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.57 -125.34 6.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.519 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -93.56 8.02 42.35 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.749 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.16 31.88 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.296 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.5 mt -80.41 134.39 36.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.602 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.53 149.72 38.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.65 0.738 . . . . 0.0 111.163 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -146.07 -166.09 2.37 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.265 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 37' ' ' LEU . 24.7 mt -128.94 145.19 51.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.386 0.613 . . . . 0.0 111.736 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 tt0 . . . . . 0 CA--C 1.5 -0.951 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.767 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.602 HD13 HG11 ' A' ' 21' ' ' VAL . 46.4 tp . . . . . 0 C--O 1.232 0.14 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.4 m -49.73 -51.76 36.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.446 HD11 ' HB2' ' A' ' 38' ' ' ALA . 27.8 pt -67.38 -18.4 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -178.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 58.4 m -100.63 14.15 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.652 0.263 . . . . 0.0 111.334 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -91.86 129.82 37.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -136.93 158.7 43.85 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.138 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 t -122.8 132.7 70.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.694 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 mt -80.73 67.59 6.66 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 12.1 mm-40 -46.81 -63.99 0.88 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -123.01 162.08 23.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.712 0.768 . . . . 0.0 112.922 -177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.5 p -153.59 86.2 1.2 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.919 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -115.8 157.03 25.0 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.661 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.2 t -70.02 150.74 46.32 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.8 t -52.84 -42.87 44.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.899 0.38 . . . . 0.0 110.323 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.1 ttp-105 -58.92 -56.87 16.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.87 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.53 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.81 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.4 -44.63 94.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.119 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 . . . . . 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 0.0 110.52 179.908 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.767 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.454 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.767 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 9.4 mtmp? -88.63 -51.82 5.48 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 125.008 1.323 . . . . 0.0 111.038 -3.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -64.85 -28.57 69.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.676 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 41.4 ttmt -61.15 -41.66 97.15 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.634 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.574 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 53.3 t80 -73.84 -45.67 49.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.958 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.3 ttt -56.63 -39.03 72.94 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.759 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 mmt -74.06 -45.65 48.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.138 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.44 -40.99 79.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.755 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.2 p -72.93 -45.65 56.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.299 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.42 -46.46 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.274 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.665 179.764 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 . . . . . 0 N--CA 1.457 -0.084 0 CA-C-O 121.069 0.462 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' THR . . . . . 0.493 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 86.5 m -79.11 146.49 33.18 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.0 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.41 131.63 35.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.576 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.96 142.91 46.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.297 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.509 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 36.4 m-85 -62.89 129.8 42.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.119 0.485 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -13.3 58.1 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.197 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.65 139.91 33.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.456 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . 0.411 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.6 127.25 32.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.26 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -111.87 159.71 11.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.606 0.717 . . . . 0.0 112.789 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.7 tp -115.39 109.18 17.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.935 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.3 mt -97.12 118.41 33.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.675 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.449 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 15.8 ttp-105 -104.24 116.59 32.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.67 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.528 ' HD1' ' HG ' ' A' ' 126' ' ' SER . 27.2 t-80 -59.78 106.75 0.52 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -51.49 -44.71 62.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -177.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 26.2 t80 -65.6 -59.17 4.23 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.528 ' HG ' ' HD1' ' A' ' 123' ' ' HIS . 59.8 p -78.2 -14.49 59.43 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 73.42 0.87 55.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.383 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -84.58 -164.79 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.441 0.162 . . . . 0.0 110.64 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.419 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.1 m-85 -134.85 138.8 44.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.5 tp -55.97 124.8 18.92 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 19.3 p -134.5 147.72 50.4 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.4 t -93.76 98.52 11.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.643 -1.162 . . . . 0.0 107.891 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.1 mt -75.7 149.67 38.04 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.283 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.7 t -80.63 4.56 18.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.861 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 79.8 p -93.5 118.87 31.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.755 0.312 . . . . 0.0 111.263 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 48.4 t . . . . . 0 C--N 1.324 -0.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.251 179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 121.518 0.675 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.527 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 11.0 m-85 -103.32 171.62 7.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.907 177.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -91.01 144.05 26.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.72 118.53 58.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.242 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.21 -150.48 5.9 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.148 -1.025 . . . . 0.0 113.172 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 81.0 mt -116.55 143.63 45.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.051 0.453 . . . . 0.0 110.832 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.455 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 1.8 tp60 -131.74 140.82 49.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.583 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.6 -51.49 19.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.509 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.427 ' HB3' HG22 ' A' ' 154' ' ' THR . 10.0 m-20 -84.61 152.17 24.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.541 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.7 p -107.86 -3.93 18.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.731 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' THR . . . . . 0.427 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.45 117.68 3.27 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.602 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 121.93 -161.29 16.11 Favored Glycine 0 N--CA 1.441 -0.992 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.829 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -118.89 -12.21 9.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.707 0.289 . . . . 0.0 111.23 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.34 -31.87 67.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.5 m -89.6 6.85 39.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.655 0.264 . . . . 0.0 111.503 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.9 131.8 54.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.08 0.467 . . . . 0.0 111.305 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.437 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.5 m95 -127.14 115.27 18.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.711 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.489 ' HG1' ' HB ' ' A' ' 184' ' ' VAL . 10.5 p -78.13 126.24 30.52 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.152 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.4 pt -87.57 135.19 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 0.0 110.794 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -127.86 149.35 70.43 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.202 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.594 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.4 Cg_endo -65.4 136.69 47.97 Favored 'Trans proline' 0 CA--C 1.517 -0.341 0 C-N-CA 122.502 2.135 . . . . 0.0 112.323 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.08 -39.55 49.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.396 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.414 ' HG ' ' HG2' ' A' ' 168' ' ' GLN . 79.0 p -104.85 -173.12 2.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.516 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -94.11 -7.09 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.931 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.424 ' HB2' ' NH1' ' A' ' 169' ' ' ARG . 2.3 mm100 -73.78 -34.03 64.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.092 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.594 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 69.7 mmt-85 -87.97 145.13 26.16 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.829 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.1 t -127.13 167.97 15.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.459 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.23 133.58 50.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.254 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.35 -16.99 58.55 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.132 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -68.04 156.33 37.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.916 0.389 . . . . 0.0 111.103 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.27 145.47 47.87 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.1 t -95.11 112.38 27.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.94 0.4 . . . . 0.0 110.263 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -77.62 154.56 32.13 Favored 'General case' 0 CA--C 1.5 -0.954 0 CA-C-O 121.353 0.597 . . . . 0.0 111.595 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 45.7 t -70.53 122.14 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.89 -13.3 32.01 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.963 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -70.16 130.13 41.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.73 0.3 . . . . 0.0 110.741 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 10.4 m-20 -73.51 115.24 12.67 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.84 149.79 23.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.818 0.818 . . . . 0.0 113.122 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.502 HD11 ' NE2' ' A' ' 209' ' ' GLN . 55.5 mt -114.26 113.17 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.84 136.87 32.86 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.175 0.512 . . . . 0.0 112.227 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.489 ' HB ' ' HG1' ' A' ' 161' ' ' THR . 84.3 t -128.77 125.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.764 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 34.5 t -65.19 123.92 20.81 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.4 t -67.44 -33.53 62.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.74 -39.54 35.92 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 65.3 m -113.35 6.94 17.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.25 32.19 0.93 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.409 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 27.6 mtt180 -114.32 141.31 47.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.918 0.39 . . . . 0.0 110.73 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.468 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.0 m-85 -72.24 153.54 41.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.25 76.8 2.37 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.407 -2.072 . . . . 0.0 105.407 175.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -76.57 151.31 36.35 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -174.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.507 HD12 ' HG ' ' A' ' 24' ' ' CYS . 13.8 tp -100.64 117.3 34.48 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.672 177.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' SER . . . . . 0.41 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 42.7 t -111.23 146.33 37.14 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.86 90.31 3.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.12 -174.53 40.77 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.464 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 71.4 m-20 -2.12 -76.62 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.42 0.688 . . . . 0.0 112.594 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 39.7 t -147.62 12.68 1.03 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.05 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.8 p -127.25 -179.86 5.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.431 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 92.1 m95 -107.22 135.92 47.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.207 0.527 . . . . 0.0 111.198 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.462 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 24.3 m-70 -127.74 173.1 10.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.108 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.86 131.98 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.104 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -149.33 172.44 14.89 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.66 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.468 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.14 94.54 6.56 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.259 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.21 174.83 5.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.129 -177.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -83.76 9.37 12.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.038 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 13.7 mm100 -115.35 136.85 52.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.534 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.502 ' NE2' HD11 ' A' ' 182' ' ' ILE . 93.8 mt-30 -66.29 175.31 2.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 122.295 1.045 . . . . 0.0 113.047 -178.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.9 m -167.98 120.82 0.88 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 113.025 -1.898 . . . . 0.0 107.891 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 37.1 mt -74.74 127.59 33.52 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.976 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.412 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.71 146.75 40.56 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.617 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.2 m -113.76 100.04 8.16 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.222 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.705 HG21 ' HG ' ' A' ' 22' ' ' LEU . 75.0 t -91.31 99.95 10.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.818 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.0 139.38 22.89 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.122 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.48 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.8 Cg_exo -63.6 106.94 0.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.018 1.812 . . . . 0.0 111.197 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.3 mm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.976 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.452 ' CD1' ' HD2' ' A' ' 176' ' ' ARG . 40.5 m-85 . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 120.907 0.384 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.8 mt -81.36 123.64 28.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.41 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -111.04 156.57 21.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.939 0.399 . . . . 0.0 111.069 -179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 18' ' ' ASP . 6.8 p -67.19 155.65 38.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.844 179.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.43 -8.3 1.38 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.77 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 16' ' ' THR . 4.0 m-20 -69.05 132.27 46.35 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.913 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -79.29 123.03 27.07 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.424 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.0 m -138.23 169.78 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.659 ' HB ' ' SG ' ' A' ' 36' ' ' CYS . 2.5 m -132.74 136.19 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.335 176.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.714 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.4 mp -97.19 126.09 42.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.808 0.337 . . . . 0.0 110.918 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 44.1 mt-30 -125.14 151.06 46.26 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.488 0.661 . . . . 0.0 111.787 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -137.63 144.12 41.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.541 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.7 m -86.12 122.03 29.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.327 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.42 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -115.07 121.99 44.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.144 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.2 m -125.63 137.66 53.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.991 0.424 . . . . 0.0 111.616 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.0 tt -174.16 143.32 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.582 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 43.5 m80 59.64 39.34 21.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.005 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.424 ' N ' ' HE2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.4 22.6 13.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.378 179.589 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -126.67 129.09 47.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.612 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -119.61 145.85 46.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.26 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -156.74 174.3 15.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.683 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -121.41 135.88 55.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.478 178.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 23' ' ' GLN . 1.8 mt -123.69 143.88 49.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.72 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.659 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 4.3 t -107.11 135.05 49.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.977 0.418 . . . . 0.0 110.56 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.9 tp -59.89 103.3 0.2 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.882 179.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.438 ' HB3' HD13 ' A' ' 64' ' ' ILE . . . -101.56 164.61 11.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.634 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.59 158.63 11.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.545 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -131.09 150.09 52.31 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.75 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.07 -4.25 89.99 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.918 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -109.04 161.55 15.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.891 0.377 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.69 -141.63 24.76 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.294 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.407 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.2 OUTLIER -84.38 11.86 7.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.776 0.322 . . . . 0.0 110.641 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.14 30.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.6 mt -79.59 135.83 36.69 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.7 m -76.75 150.84 36.19 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.304 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -144.89 -170.29 3.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.706 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.6 mt -127.4 143.04 51.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.313 0.578 . . . . 0.0 112.141 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.457 ' CD ' HD11 ' A' ' 64' ' ' ILE . 0.9 OUTLIER . . . . . 0 CA--C 1.502 -0.882 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.662 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.578 HD11 HG13 ' A' ' 21' ' ' VAL . 43.3 tp . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.6 m -54.72 -40.01 68.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.457 HD11 ' CD ' ' A' ' 50' ' ' GLU . 21.0 pt -71.66 -16.86 19.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -178.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 37' ' ' LEU . 16.6 t -105.59 4.8 30.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.247 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.1 m -76.24 125.92 30.05 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.2 161.18 35.63 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.478 HG22 HH21 ' A' ' 122' ' ' ARG . 2.8 t -125.11 133.19 70.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.673 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 23.1 mt -80.7 66.19 6.13 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.7 mm-40 -45.75 -61.39 1.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -124.37 164.36 19.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.662 0.744 . . . . 0.0 112.816 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.0 t -156.43 84.51 0.98 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.829 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.1 153.23 29.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.489 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.9 p -67.27 148.61 51.49 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.9 t -50.33 -42.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.976 0.417 . . . . 0.0 110.264 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.4 ttp85 -59.67 -50.47 73.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.14 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.03 99.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.755 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.33 -46.05 88.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.182 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 120.971 0.415 . . . . 0.0 110.583 179.892 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.798 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 7.7 mm-40 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.798 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 51.6 mtmt -86.33 -51.59 6.15 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 120.353 1.433 . . . . 0.0 111.898 -2.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -60.51 -37.35 80.84 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.977 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 52.5 mttp -57.9 -38.03 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.276 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.718 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.1 t80 -74.04 -44.38 54.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.916 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.6 ttt -57.15 -37.95 72.82 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.431 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.3 mmt -72.36 -43.7 63.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.372 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -62.06 -34.53 76.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.585 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.4 m -72.92 -49.05 31.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.279 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.98 44.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.391 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.291 -179.701 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.276 0.56 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 92.2 m -75.47 146.0 40.99 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.139 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.33 134.33 36.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.1 mt -117.64 142.06 47.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.864 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -61.67 127.96 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.67 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.45 -9.43 55.83 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.968 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -85.39 139.42 31.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 111.079 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.26 127.14 32.38 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.8 pt -112.12 157.7 12.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.587 0.708 . . . . 0.0 112.854 -178.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.7 tp -113.26 109.08 18.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.936 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.1 mt -97.06 117.71 31.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.489 HH11 ' HA2' ' A' ' 127' ' ' GLY . 60.2 ttp85 -104.22 117.79 35.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.689 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.476 ' HD1' ' H ' ' A' ' 126' ' ' SER . 30.4 t-80 -60.02 105.45 0.4 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 177.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 45.7 t -46.5 -53.91 10.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -58.12 -71.48 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.476 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 77.9 p -62.21 -25.05 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . 0.489 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 81.87 -0.82 87.93 Favored Glycine 0 C--N 1.322 -0.234 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.288 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 45.9 mtt -83.03 -164.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.489 0.185 . . . . 0.0 110.673 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.451 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.0 m-85 -135.61 139.28 43.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.56 126.1 23.86 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.7 t -136.06 147.97 48.12 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.8 t -94.42 99.07 11.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.8 mt -77.37 146.0 36.93 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.624 -178.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -0.12 17.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.932 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.2 p -88.87 121.6 31.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.72 0.295 . . . . 0.0 110.974 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 42.0 t . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.712 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.747 0 CA-C-O 121.221 0.534 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 10.5 m-85 -99.49 170.49 8.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.141 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -90.15 143.14 27.04 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.86 116.76 53.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.275 178.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.05 -151.85 6.56 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.881 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.515 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 68.7 mt -113.89 147.0 39.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.81 0.338 . . . . 0.0 110.561 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -136.69 140.79 42.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.099 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -74.16 -47.94 32.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.594 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -84.99 146.89 26.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.1 p -107.98 -10.26 15.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.99 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.1 p -54.52 112.37 0.99 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.355 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 131.87 -158.44 22.86 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.341 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.461 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.2 mt-10 -121.8 -14.43 8.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.717 0.294 . . . . 0.0 111.24 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . 0.4 ' N ' ' HB2' ' A' ' 187' ' ' SER . . . -57.61 -32.79 67.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.174 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.3 m -89.45 5.97 42.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.604 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -110.19 132.56 54.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.111 0.481 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.427 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.47 117.18 21.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.649 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.425 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 7.7 p -79.13 128.01 32.75 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.133 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.26 134.33 28.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . 0.455 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 69.8 m80 -127.96 151.85 76.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.291 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.611 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.6 Cg_endo -68.78 137.45 38.47 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.504 2.136 . . . . 0.0 112.291 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.41 43.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.438 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.1 p -105.52 -171.12 1.85 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.499 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -95.51 -0.94 51.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.0 -36.06 49.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.989 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.611 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.2 mmp_? -87.57 149.45 24.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.525 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 47.7 t -131.75 161.74 32.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.017 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.27 126.75 29.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.137 179.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.61 -14.91 57.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.688 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.79 156.57 38.77 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -72.93 136.85 45.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.372 178.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.426 HG21 HD11 ' A' ' 162' ' ' ILE . 84.3 t -85.57 119.29 33.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.378 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . 0.452 ' HD2' ' CD1' ' A' ' 13' ' ' PHE . 11.0 mmm180 -84.6 153.99 22.86 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-O 121.364 0.602 . . . . 0.0 111.513 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 40.9 t -69.66 122.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.28 -8.3 38.05 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.295 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -73.09 131.44 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.742 0.306 . . . . 0.0 110.9 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.488 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 24.5 m-20 -72.57 110.97 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 69.0 mt -97.51 149.68 21.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . 0.498 HD13 ' NE2' ' A' ' 209' ' ' GLN . 54.4 mt -114.41 113.17 42.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.13 138.6 31.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.101 0.477 . . . . 0.0 112.069 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.425 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 75.5 t -130.21 123.66 56.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.81 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' SER . . . . . 0.557 ' HG ' ' HB2' ' A' ' 188' ' ' SER . 87.5 p -65.23 119.15 10.37 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.461 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.1 t -63.17 -31.86 54.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.19 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' SER . . . . . 0.4 ' HB2' ' N ' ' A' ' 157' ' ' ALA . 44.2 t -77.49 -39.2 47.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -178.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.557 ' HB2' ' HG ' ' A' ' 185' ' ' SER . 54.7 m -116.66 9.89 14.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -177.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 185' ' ' SER . 0.4 OUTLIER 44.38 32.93 0.78 Allowed 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.584 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.469 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 29.0 mtt180 -113.31 140.27 48.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.95 0.405 . . . . 0.0 110.815 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 54.4 m-85 -72.17 153.62 41.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 31.1 tp -74.82 76.54 2.11 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 175.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -75.98 150.03 37.51 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -174.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.3 tp -100.14 116.53 32.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.602 177.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' SER . . . . . 0.402 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 49.2 p -110.1 145.39 37.22 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -105.82 91.05 3.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.15 178.83 53.43 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.032 179.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.517 ' C ' ' O ' ' A' ' 197' ' ' GLY . 54.5 m-20 9.55 -82.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.326 0.651 . . . . 0.0 112.51 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 47.5 t -143.08 4.11 1.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.527 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.4 p -119.89 -179.35 3.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.195 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.3 m95 -105.83 139.12 40.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.249 0.547 . . . . 0.0 111.341 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.431 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 32.7 m-70 -130.41 172.5 11.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.073 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.26 133.89 67.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.223 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -151.96 170.96 18.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.662 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.469 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -97.61 96.53 8.35 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.97 174.8 5.84 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.113 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -83.57 11.11 7.6 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.051 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -117.63 135.76 53.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.441 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . 0.498 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.0 mt-30 -65.56 175.23 1.89 Allowed 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 122.31 1.052 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.4 m -168.62 120.82 0.8 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.084 -1.871 . . . . 0.0 107.836 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.488 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 27.9 mt -74.88 129.11 37.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.077 0.465 . . . . 0.0 109.85 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.419 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.0 m95 -116.06 146.74 41.95 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.632 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 45.7 t -113.7 101.77 9.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.133 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.714 HG23 ' HG ' ' A' ' 22' ' ' LEU . 79.3 t -92.88 101.78 12.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.779 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.84 140.3 23.87 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.2 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.412 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.0 Cg_exo -63.74 104.03 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 121.975 1.783 . . . . 0.0 110.984 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.438 HD12 ' HA ' ' A' ' 217' ' ' ILE . 3.8 mm . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.383 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 120.844 0.354 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.0 mt -82.51 121.67 27.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.26 157.16 19.1 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.012 0.434 . . . . 0.0 111.086 -179.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.443 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.6 p -68.27 156.63 37.28 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.45 -8.94 1.11 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.701 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 16' ' ' THR . 4.8 m-20 -67.91 135.35 52.33 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -82.0 118.05 22.69 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.2 m -134.83 172.62 15.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.653 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -134.91 139.31 47.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.2 176.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.698 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.5 mp -100.0 120.93 40.59 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.689 0.281 . . . . 0.0 110.662 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.442 HE22 ' HZ1' ' A' ' 34' ' ' LYS . 24.2 mt-30 -118.19 160.19 22.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.438 0.637 . . . . 0.0 111.793 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -146.76 143.61 28.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.319 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -88.04 121.59 30.63 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.054 0.454 . . . . 0.0 110.405 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.441 ' HB2' HD13 ' A' ' 35' ' ' LEU . . . -113.0 121.72 45.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.978 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 m -126.22 130.09 50.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.986 0.422 . . . . 0.0 111.86 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.8 tt -168.74 149.23 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.51 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 44.0 m80 59.28 39.32 22.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.11 23.67 13.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -127.77 147.17 50.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.455 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -131.75 148.78 52.6 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.967 0.413 . . . . 0.0 111.028 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.435 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -161.67 165.28 28.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.672 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HZ1' HE22 ' A' ' 23' ' ' GLN . 37.9 mtmt -113.32 135.22 54.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.428 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.441 HD13 ' HB2' ' A' ' 26' ' ' ALA . 2.3 mt -124.69 142.33 51.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.728 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.585 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 47.6 t -106.36 145.58 31.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.4 . . . . 0.0 110.588 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.471 ' HA ' HD21 ' A' ' 49' ' ' LEU . 33.4 tp -65.32 114.59 4.87 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.585 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 64' ' ' ILE . . . -113.8 164.61 13.52 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.417 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 161.1 10.4 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.594 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.67 144.17 51.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.724 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.448 ' HA2' ' HE1' ' A' ' 128' ' ' MET . . . -76.8 -9.23 86.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.775 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -106.01 162.87 13.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 111.146 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.97 -142.5 26.52 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.477 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 19.6 p30 -83.02 9.71 9.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.747 0.308 . . . . 0.0 110.833 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.47 29.29 0.38 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.177 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.2 mt -79.44 137.59 37.3 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.938 0.399 . . . . 0.0 110.487 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.4 m -77.91 153.89 32.17 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.634 0.73 . . . . 0.0 111.524 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -148.34 -166.11 2.45 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.319 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.471 HD21 ' HA ' ' A' ' 37' ' ' LEU . 25.5 mt -130.44 143.89 51.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.299 0.571 . . . . 0.0 112.429 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 mt-10 . . . . . 0 CA--C 1.503 -0.859 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.594 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.573 HD11 HG13 ' A' ' 21' ' ' VAL . 45.2 tp . . . . . 0 C--O 1.231 0.094 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.2 p -45.26 -56.63 4.66 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.468 HD11 ' HB3' ' A' ' 38' ' ' ALA . 30.4 pt -67.98 -18.24 23.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.653 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.59 -3.29 46.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.917 0.389 . . . . 0.0 111.679 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.0 m -83.66 134.74 34.77 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -138.82 163.62 31.77 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' ' 124' ' ' SER . 6.0 t -127.61 133.83 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.774 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.5 mt -82.45 65.33 7.53 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.459 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 11.8 mm-40 -45.22 -66.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.438 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 20.0 mm-40 -119.25 166.61 12.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.743 0.783 . . . . 0.0 113.1 -177.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.4 t -159.62 82.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.402 -1.272 . . . . 0.0 108.746 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.9 mt -111.6 157.11 20.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.388 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 t -69.13 150.04 47.99 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 41.3 t -52.88 -42.94 44.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.06 0.457 . . . . 0.0 110.18 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -59.24 -51.74 68.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.25 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.15 98.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.721 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.81 -44.32 96.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.001 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 . . . . . 0 C--N 1.323 -0.552 0 CA-C-O 120.911 0.386 . . . . 0.0 110.645 179.864 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.705 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 15.3 mm-40 . . . . . 0 CA--C 1.534 0.35 0 CA-C-O 118.644 -0.694 . . . . 0.0 112.74 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.705 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 46.9 mtmt -86.27 -49.81 7.42 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 0.0 110.881 -2.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.422 ' O ' ' HG2' ' A' ' 102' ' ' MET . 49.0 t90 -53.97 -43.66 70.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.651 -178.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.608 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -58.37 -30.3 66.68 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.153 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.68 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 9.8 t80 -73.87 -47.52 37.59 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.523 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 14.9 tpt -56.71 -38.62 72.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.603 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.422 ' HG2' ' O ' ' A' ' 98' ' ' TRP . 91.2 mmm -72.74 -43.37 63.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -57.45 -40.01 77.53 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.474 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 74.1 p -72.45 -46.83 53.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.97 -26.61 67.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.894 179.862 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.913 0.387 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.7 m -75.8 146.7 39.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.287 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.2 131.68 35.31 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.768 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -116.04 141.98 47.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.244 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.58 129.13 39.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.451 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.16 -13.43 57.24 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.951 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.37 141.93 32.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.053 0.454 . . . . 0.0 111.303 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.74 125.22 31.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.3 pt -110.31 160.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.487 HD21 HG21 ' A' ' 153' ' ' THR . 20.0 tp -116.84 111.62 19.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.036 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 52.7 mt -98.82 117.69 33.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.495 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.454 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 17.2 ttp-105 -103.24 115.53 30.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.763 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.9 t-80 -58.18 108.19 0.57 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.428 ' HG ' HG21 ' A' ' 68' ' ' VAL . 44.0 m -52.82 -46.27 67.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.489 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 60.4 t80 -63.33 -59.28 4.92 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.468 ' HB3' ' HD1' ' A' ' 123' ' ' HIS . 45.2 t -78.27 -17.0 57.24 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.67 -2.33 59.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.552 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.448 ' HE1' ' HA2' ' A' ' 41' ' ' GLY . 62.3 mtm -84.13 -167.11 1.63 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.459 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 63.5 m-85 -130.93 139.0 50.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.436 HD12 HD21 ' A' ' 37' ' ' LEU . 30.3 tp -54.87 128.69 34.32 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 46.2 t -137.72 147.78 45.07 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.5 t -95.07 98.38 10.62 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.491 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.8 mt -75.33 153.43 37.86 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.618 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.0 t -80.66 -4.59 54.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.769 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 32.4 p -83.95 122.01 28.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.728 0.299 . . . . 0.0 111.131 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 50.8 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 121.312 0.577 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.491 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 15.6 m-85 -101.61 172.22 7.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.143 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -90.52 145.13 25.13 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 92.7 t -115.2 117.39 55.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.307 178.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.39 -149.58 5.84 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.87 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.0 mt -114.63 150.03 35.73 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.852 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' A' ' 133' ' ' LEU . 2.4 tp-100 -137.4 139.34 40.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.775 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -68.63 -68.43 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.543 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -74.97 154.35 38.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.712 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' THR . . . . . 0.487 HG21 HD21 ' A' ' 120' ' ' LEU . 81.4 p -106.3 3.96 28.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.013 0.435 . . . . 0.0 111.096 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 74.9 p -59.15 114.12 2.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.312 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.35 -164.39 18.94 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.656 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.8 mt-10 -116.27 -13.8 11.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.676 0.274 . . . . 0.0 111.306 -179.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.34 65.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.198 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 30.0 p -88.83 6.67 37.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.632 0.253 . . . . 0.0 111.674 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -110.4 133.53 53.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.153 0.501 . . . . 0.0 111.347 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.422 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.3 m95 -127.78 115.96 19.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.623 -179.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.4 p -78.12 123.33 26.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.049 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.0 pt -85.89 136.93 21.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.99 0.424 . . . . 0.0 110.982 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -128.75 149.84 73.24 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.034 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.609 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 38.5 Cg_endo -66.71 137.79 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.449 2.1 . . . . 0.0 112.38 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.61 -42.47 51.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -107.92 -169.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -91.64 -8.59 46.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.066 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -67.98 -38.31 82.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.047 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.609 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.6 mmp_? -88.59 150.84 22.85 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.824 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 60.4 m -133.28 167.83 19.67 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.881 0.372 . . . . 0.0 111.011 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.53 127.94 34.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.528 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.27 -14.72 63.28 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.086 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.53 155.98 40.01 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.031 0.443 . . . . 0.0 111.313 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 43.9 mttp -72.56 141.48 48.45 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.4 HG12 HD22 ' A' ' 181' ' ' LEU . 86.1 t -91.11 120.92 40.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -84.8 153.81 22.74 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-O 121.156 0.503 . . . . 0.0 111.381 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.11 122.22 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.39 -14.77 35.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.399 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.33 127.13 31.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.947 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.548 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.9 m-20 -68.52 110.06 4.02 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.438 HD11 HG22 ' A' ' 214' ' ' VAL . 69.4 mt -96.36 149.23 21.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.79 0.805 . . . . 0.0 112.924 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.06 112.51 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.9 mp -92.96 135.64 33.97 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.14 -178.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . . . . . . . . . 84.9 t -127.75 127.75 68.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.75 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -64.43 127.86 33.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -71.22 -31.82 45.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.698 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.0 t -80.08 -36.65 35.22 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.507 ' HG ' ' HB2' ' A' ' 190' ' ' ARG . 60.4 p -116.74 2.4 12.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 50.42 28.31 3.24 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 179.772 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.507 ' HB2' ' HG ' ' A' ' 188' ' ' SER . 26.0 mtt180 -108.89 140.76 41.92 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.937 0.399 . . . . 0.0 110.99 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.3 m-85 -72.03 153.77 41.55 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.42 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 28.5 tp -75.31 76.72 2.41 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 105.253 -2.129 . . . . 0.0 105.253 175.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -76.82 149.66 36.18 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 115.454 1.649 . . . . 0.0 115.454 -174.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.452 ' H ' ' HG1' ' A' ' 210' ' ' THR . 12.1 tp -99.0 115.02 27.97 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 113.78 -1.554 . . . . 0.0 107.622 177.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.0 t -107.83 146.54 32.11 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -177.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -106.0 91.89 3.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.49 -175.07 47.05 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.36 -0.924 . . . . 0.0 111.507 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 79.6 m-20 -0.25 -78.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.379 0.671 . . . . 0.0 112.386 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 79.3 p -146.2 12.65 1.23 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.095 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 77.0 p -126.57 -178.54 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.868 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.411 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 93.6 m95 -107.81 136.3 47.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.223 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.472 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 21.4 m-70 -129.15 173.27 10.63 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.949 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.45 131.27 71.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.204 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -147.72 170.19 18.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.544 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.463 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.61 94.19 6.84 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -112.79 176.5 4.99 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.09 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.32 7.96 20.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.1 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -114.43 136.37 53.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.733 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.81 174.52 1.82 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.45 1.119 . . . . 0.0 113.119 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.452 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 24.8 m -168.61 119.86 0.78 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 112.886 -1.961 . . . . 0.0 107.72 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 48.7 mt -73.68 129.8 38.69 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.956 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.435 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -116.89 138.5 51.49 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.738 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.7 m -105.44 100.65 10.22 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.711 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.698 HG21 ' HG ' ' A' ' 22' ' ' LEU . 87.4 t -91.96 101.58 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.777 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.89 142.32 28.22 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.196 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.76 104.97 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.18 1.92 . . . . 0.0 111.116 178.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.449 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.5 mm . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.24 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.3 mt -81.04 122.72 27.66 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -110.0 156.83 19.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.063 0.459 . . . . 0.0 111.093 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.441 ' HG1' ' H ' ' A' ' 111' ' ' ARG . 10.5 p -68.2 155.33 39.88 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.753 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 71.97 -4.03 2.06 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.753 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.417 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.46 134.43 45.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.623 179.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -81.26 120.98 25.59 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.414 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.84 171.61 15.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -177.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.507 HG11 HD13 ' A' ' 62' ' ' LEU . 3.2 m -132.82 137.4 54.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.349 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.707 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.6 mp -98.11 124.87 42.86 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 21.6 mt-30 -125.64 143.32 51.08 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.439 0.638 . . . . 0.0 112.339 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -128.89 144.08 51.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.851 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -86.61 120.58 28.08 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.134 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.44 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.19 121.25 44.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.258 -179.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 m -124.5 137.63 54.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.622 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.8 tt -177.64 146.16 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.581 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 47.8 m80 58.97 40.12 22.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.183 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 60.64 22.03 11.9 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.283 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -126.46 138.4 53.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.452 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -126.65 147.63 49.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.974 0.416 . . . . 0.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -159.39 172.84 17.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.564 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -120.47 140.42 51.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.45 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -128.97 143.57 50.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.424 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.9 p -106.96 138.33 43.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.014 0.435 . . . . 0.0 110.722 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HA ' HD22 ' A' ' 49' ' ' LEU . 29.5 tp -60.08 111.04 1.36 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.091 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.414 ' HB1' HD13 ' A' ' 64' ' ' ILE . . . -111.39 165.68 11.76 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.599 -179.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.87 163.36 13.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.811 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -134.67 145.35 48.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.522 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.92 12.18 58.18 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.782 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -121.14 151.39 39.96 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.926 0.393 . . . . 0.0 110.808 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.9 -137.34 18.52 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.425 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.3 OUTLIER -83.31 8.99 11.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.789 0.328 . . . . 0.0 110.893 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.487 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.28 31.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.099 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.415 ' H ' HD21 ' A' ' 44' ' ' ASN . 39.5 mt -78.52 135.06 37.24 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 110.509 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.3 m -75.66 150.52 37.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.56 0.695 . . . . 0.0 111.297 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -144.03 -167.13 2.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 108.594 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.529 HD22 ' HA ' ' A' ' 37' ' ' LEU . 29.8 mt -131.87 142.82 49.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.7 mt-10 . . . . . 0 CA--C 1.503 -0.856 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.794 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.507 HD13 HG11 ' A' ' 21' ' ' VAL . 48.3 tp . . . . . 0 C--O 1.231 0.091 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.2 m -53.14 -48.74 67.68 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.414 HD13 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -68.27 -17.68 22.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 61.2 m -99.92 13.75 32.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -92.01 130.97 37.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.567 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.7 159.12 42.84 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.259 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.503 HG23 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -123.51 133.68 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.606 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.404 HD11 ' HB2' ' A' ' 18' ' ' ASP . 18.9 mt -81.72 64.77 6.57 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.483 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 9.5 mm-40 -44.13 -61.28 1.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -178.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -125.21 165.4 18.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.706 0.765 . . . . 0.0 112.889 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -157.82 85.67 0.9 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.935 179.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -113.84 159.22 20.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.469 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.42 ' HB2' HH12 ' A' ' 76' ' ' ARG . 9.4 m -70.25 149.13 47.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.4 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 56.1 t -52.0 -45.05 40.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.004 0.43 . . . . 0.0 110.219 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.42 HH12 ' HB2' ' A' ' 74' ' ' SER . 1.9 tmm_? -57.37 -54.55 45.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.26 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.41 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -58.75 -44.96 90.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.909 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.6 tp -60.67 -47.17 87.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.444 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 96.3 mt-30 . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.868 0.365 . . . . 0.0 110.669 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.793 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 2.2 mm-40 . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.791 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.793 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 56.2 mtpt -87.43 -51.85 5.7 Favored 'General case' 0 C--N 1.353 0.75 0 CA-C-N 120.324 1.42 . . . . 0.0 111.592 -3.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -66.31 -28.48 68.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.918 -1.492 . . . . 0.0 113.031 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.625 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.2 mptm? -60.29 -45.88 91.79 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.876 -0.729 . . . . 0.0 110.132 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . 0.589 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 22.6 t80 -74.14 -41.95 60.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.261 179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -56.83 -46.35 81.75 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.982 0.42 . . . . 0.0 110.557 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.1 tmm? -71.04 -41.98 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.736 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -57.47 -40.39 78.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.745 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 49.2 p -73.05 -52.71 13.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.273 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.71 -27.45 62.97 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.459 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.741 -179.921 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.441 ' H ' ' HG1' ' A' ' 16' ' ' THR . 16.6 ptp180 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 121.144 0.497 . . . . 0.0 111.5 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 98.0 m -79.56 146.74 32.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.16 131.92 35.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.826 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.28 141.98 47.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.041 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -62.32 126.07 26.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.093 0.473 . . . . 0.0 110.59 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.48 -11.34 50.61 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.053 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 141.26 31.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.06 126.97 32.61 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.2 pt -112.05 160.27 11.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.564 0.697 . . . . 0.0 112.777 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.453 HD22 HG22 ' A' ' 153' ' ' THR . 20.3 tp -115.78 110.38 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.053 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 61.9 mt -98.4 116.51 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.641 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.503 ' NH2' HG23 ' A' ' 68' ' ' VAL . 56.1 ttp85 -102.81 116.38 32.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.62 179.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.461 ' HD1' ' CB ' ' A' ' 126' ' ' SER . 24.7 t-80 -59.37 106.54 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 177.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.2 t -50.72 -45.65 58.64 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 37.5 t80 -65.27 -59.55 3.94 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' SER . . . . . 0.461 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 11.4 m -75.76 -16.42 60.13 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -3.35 48.49 Favored Glycine 0 N--CA 1.454 -0.159 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.379 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 61.9 mtm -84.76 -166.25 1.42 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.483 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.1 m-85 -131.67 140.53 49.36 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -177.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.8 tp -55.23 129.55 38.75 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.0 t -138.69 149.26 44.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.1 t -96.4 95.98 8.41 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 176.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.522 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.4 mt -71.85 154.53 41.2 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.412 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.2 m -83.96 3.58 33.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.048 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.1 p -90.8 127.19 36.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.717 0.294 . . . . 0.0 111.018 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.0 p . . . . . 0 C--N 1.327 -0.406 0 CA-C-O 120.846 0.355 . . . . 0.0 110.75 179.799 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.154 0.502 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 12.4 m-85 -98.12 167.2 11.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.264 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -87.05 145.51 26.44 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.041 0.448 . . . . 0.0 109.96 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 89.7 t -115.06 116.56 52.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.51 -151.62 6.25 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.705 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.487 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.5 mt -112.67 148.55 34.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.949 0.404 . . . . 0.0 110.737 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.19 40.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.87 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.5 -77.87 0.06 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.674 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.05 153.06 44.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' THR . . . . . 0.453 HG22 HD22 ' A' ' 120' ' ' LEU . 73.2 p -104.3 4.02 33.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.099 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.4 p -56.2 115.46 2.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.67 -162.29 16.53 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.636 -0.792 . . . . 0.0 111.741 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . 0.52 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.1 mt-10 -118.97 -9.96 9.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.707 0.289 . . . . 0.0 111.39 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.93 -31.13 68.39 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -91.18 8.1 37.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.583 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.6 133.09 54.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.458 . . . . 0.0 111.183 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' TRP . . . . . 0.444 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.8 m95 -128.57 117.41 21.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.779 -178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' THR . . . . . 0.426 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 10.7 p -79.2 125.99 30.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.136 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.2 pt -87.69 136.41 23.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.928 0.394 . . . . 0.0 110.938 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -128.6 150.94 76.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.087 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.647 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.0 Cg_endo -67.84 140.92 52.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.488 2.125 . . . . 0.0 112.286 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.87 -46.22 54.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.809 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.426 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 58.9 m -112.92 -171.09 1.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.44 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' LYS . . . . . 0.479 ' HG3' ' NE2' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -88.51 8.27 28.9 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.235 -179.624 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.479 ' NE2' ' HG3' ' A' ' 167' ' ' LYS . 8.7 mm-40 -81.36 -37.8 27.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.059 0.457 . . . . 0.0 110.567 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.647 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 78.4 mmt-85 -91.82 150.46 21.06 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.402 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' SER . . . . . 0.469 ' HG ' ' H ' ' A' ' 171' ' ' GLU . 44.9 t -128.46 166.53 18.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.136 -179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . 0.469 ' H ' ' HG ' ' A' ' 170' ' ' SER . 0.8 OUTLIER -67.99 128.54 36.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.309 179.55 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 98.3 -16.39 60.03 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.877 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -69.1 156.38 38.77 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.929 0.395 . . . . 0.0 111.201 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -72.95 143.48 47.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . 0.405 HG13 HD23 ' A' ' 181' ' ' LEU . 93.0 t -93.43 118.89 40.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.458 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -83.39 155.34 23.54 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.322 0.582 . . . . 0.0 111.563 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 30.7 t -69.46 120.95 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 176.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -15.13 33.19 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.379 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -65.68 128.76 37.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.697 0.284 . . . . 0.0 110.732 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 3.9 m-20 -69.76 111.17 5.34 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' LEU . . . . . 0.405 HD23 HG13 ' A' ' 175' ' ' VAL . 76.8 mt -97.27 148.73 22.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.65 112.02 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' LEU . . . . . 0.468 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -91.89 138.24 31.71 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.141 0.496 . . . . 0.0 112.108 -178.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' VAL . . . . . 0.427 HG21 ' CD1' ' A' ' 191' ' ' TYR . 88.9 t -129.15 128.21 66.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.797 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -65.48 127.36 31.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.52 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 87.8 t -71.93 -33.35 47.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.637 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.7 p -80.42 -36.02 34.29 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 63.2 m -114.83 2.41 14.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 49.31 29.02 2.53 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 190' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.3 mtt180 -111.63 140.19 46.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 110.87 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 191' ' ' TYR . . . . . 0.472 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.0 m-85 -71.11 155.12 41.14 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.7 tp -75.52 75.83 2.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 193' ' ' HIS . . . . . 0.449 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.4 t60 -75.46 150.09 38.33 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -174.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 194' ' ' LEU . . . . . 0.406 ' H ' ' HG1' ' A' ' 210' ' ' THR . 13.5 tp -100.21 112.6 24.93 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 113.649 -1.614 . . . . 0.0 107.639 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 62.9 p -105.0 145.69 30.08 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.23 91.36 3.76 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 197' ' ' GLY . . . . . 0.532 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.69 -174.49 44.6 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.511 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 11.9 m-80 -0.42 -78.92 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.302 0.641 . . . . 0.0 112.366 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 50.4 m -146.93 13.19 1.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.927 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.8 p -126.61 -177.81 4.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.917 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 201' ' ' TRP . . . . . 0.44 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.6 m95 -108.56 135.09 50.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.314 0.578 . . . . 0.0 111.341 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 202' ' ' HIS . . . . . 0.502 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.4 m-70 -128.33 174.11 9.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.4 p -126.78 132.14 70.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 52.0 p-10 -150.09 167.11 27.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.715 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 205' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.32 95.27 8.79 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.32 173.64 6.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.339 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -81.55 8.01 10.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 208' ' ' GLN . . . . . 0.449 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 74.9 mm-40 -114.67 137.42 51.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.731 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -66.13 174.82 2.36 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 122.279 1.038 . . . . 0.0 112.809 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 210' ' ' THR . . . . . 0.406 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 27.0 m -168.01 121.02 0.89 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.186 -1.824 . . . . 0.0 107.945 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 211' ' ' LEU . . . . . 0.436 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 68.4 mt -75.37 128.06 34.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.98 0.419 . . . . 0.0 109.967 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.64 145.77 42.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.9 m -114.01 102.36 10.11 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.206 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 214' ' ' VAL . . . . . 0.707 HG23 ' HG ' ' A' ' 22' ' ' LEU . 80.4 t -93.39 105.55 16.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.041 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -116.69 141.4 28.07 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.247 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 216' ' ' PRO . . . . . 0.472 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.5 Cg_exo -64.31 104.73 0.53 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.194 1.929 . . . . 0.0 111.192 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 217' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.7 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.986 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.453 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 23.7 mm-40 . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -119.19 153.14 35.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.913 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.79 126.09 30.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.42 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 10.5 mmm180 -112.83 156.59 22.63 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.096 0.475 . . . . 0.0 111.226 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 p -67.46 156.09 37.44 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.801 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 70.92 -2.84 2.18 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.856 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.42 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.1 m-20 -73.25 133.82 44.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.6 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -80.8 120.49 24.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.424 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -136.42 171.98 16.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.532 HG11 HD11 ' A' ' 62' ' ' LEU . 3.3 m -133.09 135.79 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 114.682 -1.145 . . . . 0.0 108.239 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -96.85 123.65 40.61 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.563 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 69.9 mt-30 -120.42 163.05 18.48 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.4 0.619 . . . . 0.0 111.359 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -150.96 139.43 20.48 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.422 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -83.81 121.41 27.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.513 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.4 ' HB1' HD13 ' A' ' 35' ' ' LEU . . . -114.67 119.09 35.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.968 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.4 m -122.91 136.9 55.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.002 0.43 . . . . 0.0 111.695 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.6 tt -171.49 145.32 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.3 m80 59.29 37.84 23.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.42 22.52 13.29 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.503 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.62 131.93 49.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.405 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -118.81 144.42 46.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.025 0.44 . . . . 0.0 111.41 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -154.03 171.93 18.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.631 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -119.41 141.14 49.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.429 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 51' ' ' SER . 1.7 mt -130.23 141.97 50.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.469 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.8 p -106.38 138.19 43.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.022 0.439 . . . . 0.0 110.531 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.508 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.6 tp -60.02 110.46 1.2 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.187 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.458 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.83 165.15 11.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.518 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.92 167.14 9.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.801 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.02 150.62 44.64 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.537 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.11 -2.64 89.34 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.967 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -108.84 156.07 20.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 111.025 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.09 -141.6 23.41 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.276 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.443 HD21 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -81.07 7.88 9.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.753 0.311 . . . . 0.0 110.623 179.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.11 30.04 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.847 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.443 ' H ' HD21 ' A' ' 44' ' ' ASN . 41.8 mt -78.26 139.58 38.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.007 0.432 . . . . 0.0 110.415 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.5 m -80.15 150.5 30.17 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.545 0.688 . . . . 0.0 111.208 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -145.04 -168.6 2.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.658 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.508 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.8 mt -128.64 143.86 51.04 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.445 0.64 . . . . 0.0 112.031 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -110.63 139.08 46.22 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.809 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.488 ' HA ' HD21 ' A' ' 35' ' ' LEU . 47.3 t -77.57 140.13 39.65 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 176.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.516 HG21 ' HB3' ' A' ' 59' ' ' PRO . 72.1 p -109.54 172.75 6.67 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.178 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.726 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 47.0 t 18.1 59.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.579 -1.191 . . . . 0.0 112.814 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -102.08 -25.25 13.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.365 0.602 . . . . 0.0 109.614 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.518 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 69.4 p -164.69 67.95 0.15 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.225 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.518 ' HA ' ' N ' ' A' ' 55' ' ' SER . 24.1 pttm -149.1 39.98 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 122.692 0.397 . . . . 0.0 111.501 0.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.442 ' N ' ' HA ' ' A' ' 53' ' ' SER . 59.9 t30 -172.1 123.37 0.5 Allowed 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.726 ' H ' ' HB2' ' A' ' 53' ' ' SER . 0.6 OUTLIER 60.88 166.01 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.51 178.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.637 ' HD2' HG23 ' A' ' 58' ' ' VAL . 18.6 Cg_endo -62.76 138.93 72.01 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.167 1.911 . . . . 0.0 111.971 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -54.26 -40.02 84.15 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.299 1.999 . . . . 0.0 111.128 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -122.2 87.61 2.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.532 HD11 HG11 ' A' ' 21' ' ' VAL . 52.1 tp -70.08 -25.82 63.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.134 -178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t -55.67 -47.22 77.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.458 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.7 pt -68.78 -16.76 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 67.6 m -101.3 13.76 34.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.889 0.376 . . . . 0.0 110.826 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.5 m -91.56 130.18 37.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.717 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -136.78 159.94 40.34 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.097 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.524 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -124.09 132.03 71.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.654 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 23.5 mt -79.92 65.73 5.17 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.6 mm-40 -44.53 -64.53 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.419 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -122.81 165.35 16.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 112.963 -177.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.9 m -156.89 86.51 0.98 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.022 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.2 mt -114.22 158.23 21.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.472 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.8 t -70.24 148.19 48.86 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 177.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.41 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.6 t -51.33 -45.1 32.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -57.82 -52.77 64.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.093 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -61.7 -43.13 99.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.9 tp -61.47 -48.23 82.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.199 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 25.8 mt-30 -65.17 -34.33 78.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.67 -44.14 87.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.772 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.9 mtt -60.8 -46.8 89.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.875 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.64 -33.75 76.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.002 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.44 -35.24 77.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.817 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.19 -18.13 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.444 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.5 p -90.8 1.9 56.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.523 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.445 HG13 ' HG3' ' A' ' 87' ' ' GLU . 23.3 t -80.06 -60.47 2.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.87 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.445 ' HG3' HG13 ' A' ' 86' ' ' VAL . 44.9 mt-10 -147.48 90.3 1.85 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -168.98 129.33 1.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.736 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.5 m -77.57 -28.38 51.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.846 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -87.83 172.69 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.722 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.52 32.88 4.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.847 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -97.25 116.44 29.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.717 0.294 . . . . 0.0 110.825 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HB ' HG21 ' A' ' 104' ' ' THR . 26.7 m -76.45 -24.47 15.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.277 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -112.24 86.02 2.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.541 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 39.2 t -86.11 -27.02 6.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.696 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 9.9 tp10 -57.96 -41.38 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.124 0.786 . . . . 0.0 113.124 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.696 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.1 pttm -80.74 -26.06 37.62 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.525 1.53 . . . . 0.0 112.698 -0.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -52.16 -57.46 9.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.583 ' H ' ' HG2' ' A' ' 96' ' ' GLU . 1.7 tmtp? -57.08 -52.39 65.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.347 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.416 ' HB2' ' H ' ' A' ' 96' ' ' GLU . 28.9 m-85 -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.871 0.367 . . . . 0.0 110.599 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 28.3 ttt -71.31 -40.41 70.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.802 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 24.1 ttt -68.35 -35.75 78.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.66 -44.64 70.11 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.479 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.457 HG21 ' HB ' ' A' ' 93' ' ' VAL . 29.2 p -65.93 -38.44 88.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.186 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -68.72 -44.86 72.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -74.84 -23.21 58.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.734 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.39 -33.1 23.57 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.676 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.22 -98.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.576 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.639 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . 159.93 177.3 32.9 Favored Glycine 0 CA--C 1.523 0.539 0 CA-C-O 119.287 -0.729 . . . . 0.0 112.241 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.639 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 35.6 m-70 55.99 70.32 0.65 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.075 1.438 . . . . 0.0 112.146 0.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -149.18 143.85 26.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.123 0.487 . . . . 0.0 111.157 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 87.8 m -74.03 146.27 43.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.212 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.96 133.77 35.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.701 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.5 mt -117.01 141.83 47.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.243 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -61.89 129.7 42.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.067 0.46 . . . . 0.0 110.463 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -12.09 58.05 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.117 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.44 140.75 32.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.096 0.474 . . . . 0.0 111.513 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.28 126.79 32.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.142 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 48.2 pt -111.97 159.54 11.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.471 0.653 . . . . 0.0 112.746 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.419 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.2 tp -114.51 108.8 17.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.889 -1.051 . . . . 0.0 109.895 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 67.0 mt -97.01 116.72 29.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.703 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.524 ' NH2' HG21 ' A' ' 68' ' ' VAL . 48.8 ttp85 -102.87 116.49 32.66 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.665 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.502 ' HD1' ' HB3' ' A' ' 126' ' ' SER . 26.2 t-80 -59.47 106.55 0.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 43.1 t -49.76 -47.38 50.97 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.454 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 57.5 t80 -64.26 -61.23 2.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.502 ' HB3' ' HD1' ' A' ' 123' ' ' HIS . 37.8 t -74.26 -16.83 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.43 -2.77 51.59 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.379 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.441 ' HE3' ' OG ' ' A' ' 126' ' ' SER . 54.2 mtt -83.46 -165.55 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.469 0.176 . . . . 0.0 110.626 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.471 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.7 m-85 -133.7 138.86 46.07 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.416 HD13 HD22 ' A' ' 37' ' ' LEU . 25.8 tp -55.65 125.54 21.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 17.7 p -136.26 147.71 47.67 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.4 t -93.15 98.6 11.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.518 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.7 mt -75.53 146.65 40.35 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.374 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -77.95 5.9 8.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.019 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.3 p -97.95 120.56 38.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 66.5 m -74.92 -60.23 2.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.918 0.389 . . . . 0.0 110.264 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.426 ' HB2' ' OD2' ' A' ' 146' ' ' ASP . 19.5 mmm180 54.54 31.49 15.01 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.332 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.0 m -136.36 -30.48 0.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.865 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.6 t -166.77 166.91 15.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.961 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.0 p -91.37 -3.9 56.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.098 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.58 -0.45 53.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm 57.04 33.34 23.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.565 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -74.19 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.831 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -113.11 151.51 30.73 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.504 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 11.6 m-85 -100.91 173.32 6.54 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.043 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . 0.426 ' OD2' ' HB2' ' A' ' 137' ' ' ARG . 43.4 m-20 -92.51 145.13 24.69 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 93.3 t -114.33 116.1 51.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.174 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.54 -152.82 6.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.002 -1.094 . . . . 0.0 113.246 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 52.4 mt -113.22 143.44 44.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.823 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.462 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -129.37 141.13 51.14 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.831 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.85 -52.71 13.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.487 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.46 ' HB3' HG23 ' A' ' 154' ' ' THR . 7.5 m-20 -87.66 151.36 23.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.691 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 67.2 p -104.96 -6.34 20.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.823 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' THR . . . . . 0.46 HG23 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.37 115.59 2.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.467 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.14 -159.22 19.73 Favored Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.654 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.494 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -120.53 -13.9 8.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.719 0.295 . . . . 0.0 111.416 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.83 -33.35 66.68 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.6 m -88.62 6.22 39.28 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -110.02 133.75 52.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.146 0.498 . . . . 0.0 111.418 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 56.6 m95 -128.56 117.54 21.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.715 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 14.4 p -79.1 127.64 32.27 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.095 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.1 pt -89.64 134.83 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.986 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -128.61 151.72 77.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.262 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.647 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.1 Cg_endo -67.85 140.73 51.62 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.5 2.134 . . . . 0.0 112.515 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.83 -44.19 42.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 52.1 m -109.29 -173.64 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.132 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.558 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -90.46 6.15 44.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.147 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.558 HE22 ' HE2' ' A' ' 167' ' ' LYS . 10.5 mm-40 -80.58 -36.53 32.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.488 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.647 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 65.5 mmt-85 -90.0 148.16 23.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.229 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.4 m -127.99 166.8 17.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 111.382 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -66.64 133.81 51.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.235 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.96 -16.91 58.38 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.087 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -67.49 157.3 34.6 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.016 0.436 . . . . 0.0 111.313 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -74.36 140.53 44.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.238 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 88.0 t -90.23 119.84 38.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.371 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 25.7 mmt180 -83.61 154.85 23.53 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-O 121.283 0.564 . . . . 0.0 111.406 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 31.6 t -69.55 120.47 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.94 -7.81 35.95 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.376 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -71.45 129.33 38.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 110.853 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.535 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.2 m-20 -70.8 109.84 5.23 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 63.9 mt -97.14 149.67 21.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.759 0.79 . . . . 0.0 113.035 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 52.8 mt -114.46 112.94 42.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.83 136.7 33.01 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.161 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.418 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 74.1 t -128.73 123.13 58.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.735 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.577 ' HG ' ' HB3' ' A' ' 188' ' ' SER . 91.4 p -62.5 125.59 24.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.494 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 80.1 t -68.7 -32.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.166 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 89.5 p -77.52 -38.49 48.74 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.577 ' HB3' ' HG ' ' A' ' 185' ' ' SER . 41.2 t -115.59 2.95 13.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.38 27.17 3.51 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 20.9 mtt180 -107.79 142.5 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.974 0.416 . . . . 0.0 110.927 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.1 m-85 -73.74 154.9 39.41 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.421 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.0 tp -76.42 76.56 3.16 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -76.81 149.41 36.22 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 115.644 1.72 . . . . 0.0 115.644 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.439 ' H ' ' HG1' ' A' ' 210' ' ' THR . 14.7 tp -98.7 119.58 37.68 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.639 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.8 p -113.79 144.37 43.1 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -103.81 92.23 4.33 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.521 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -81.82 -176.86 51.44 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.321 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.521 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.3 m-20 4.28 -80.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.406 0.682 . . . . 0.0 112.449 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 37.5 t -145.24 8.2 1.2 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.019 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 57.3 m -122.39 -177.84 3.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -108.01 138.14 44.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.169 0.509 . . . . 0.0 111.129 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.435 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 28.3 m-70 -129.79 173.05 11.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.216 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.58 133.38 67.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.23 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.7 171.22 17.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.71 94.94 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.409 ' HB3' ' OD1' ' A' ' 204' ' ' ASP . . . -115.03 173.29 6.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.005 -178.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -82.41 10.56 6.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -116.43 137.64 52.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.523 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -67.12 174.91 2.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 122.297 1.046 . . . . 0.0 113.303 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.439 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 28.4 m -169.16 121.7 0.77 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 112.931 -1.94 . . . . 0.0 107.812 178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.4 mt -74.74 130.58 39.73 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.018 0.437 . . . . 0.0 109.838 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -118.52 133.08 56.15 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.083 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 52.2 m -99.78 102.17 13.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.998 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.7 HG22 ' HG ' ' A' ' 22' ' ' LEU . 89.3 t -93.26 102.89 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.13 139.76 24.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.458 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.8 Cg_exo -63.8 105.82 0.58 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.134 1.889 . . . . 0.0 111.174 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.5 mm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.022 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.54 HE21 ' H ' ' A' ' 13' ' ' PHE . 20.3 tp60 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.788 0.328 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.54 ' H ' HE21 ' A' ' 12' ' ' GLN . 50.7 m-85 -120.18 157.6 28.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.448 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.15 121.91 26.7 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.48 157.2 19.2 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.104 0.478 . . . . 0.0 111.17 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -67.89 156.03 38.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.586 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 16' ' ' THR . 14.3 m-20 70.99 -3.29 2.06 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.89 -179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.9 m-20 -73.58 133.23 43.48 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -79.69 119.18 22.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.422 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -135.02 174.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.601 HG13 HD13 ' A' ' 62' ' ' LEU . 3.7 m -134.0 140.94 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.367 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.712 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -102.64 116.64 32.99 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.789 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.455 HE22 ' HE2' ' A' ' 34' ' ' LYS . 17.9 mt-30 -119.15 138.42 52.94 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.453 0.644 . . . . 0.0 112.259 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.541 ' HG ' HD12 ' A' ' 194' ' ' LEU . 26.0 p -123.06 143.8 49.72 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.648 178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.7 m -84.35 123.18 29.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.391 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.418 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -114.59 122.04 45.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.338 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.1 m -125.01 136.21 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.62 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.3 tt -172.75 144.5 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.366 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.0 m80 58.59 37.5 25.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.918 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.76 26.21 15.5 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.327 179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -128.18 132.61 48.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.33 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -122.77 145.17 48.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.076 0.465 . . . . 0.0 111.396 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -156.39 178.62 10.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.783 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.455 ' HE2' HE22 ' A' ' 23' ' ' GLN . 32.7 mtmm -124.14 137.41 54.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.513 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.94 132.15 50.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.808 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.8 p -94.11 145.83 24.4 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.418 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 49' ' ' LEU . 34.2 tp -69.2 108.94 3.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.081 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.495 ' HB3' HD11 ' A' ' 64' ' ' ILE . . . -106.18 164.0 12.35 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.305 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.93 164.71 13.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.44 140.86 39.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.659 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.01 17.25 28.36 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.246 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -121.29 146.11 47.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.691 0.282 . . . . 0.0 110.469 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.12 -135.15 14.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.371 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.415 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.2 OUTLIER -84.02 9.16 13.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 110.996 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.477 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.06 33.63 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.222 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 25.4 mt -79.94 136.15 36.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.976 0.417 . . . . 0.0 110.652 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.9 m -76.9 151.28 35.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.539 0.685 . . . . 0.0 111.219 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -146.02 -170.74 3.55 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.736 -1.12 . . . . 0.0 108.538 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.484 HD22 ' HA ' ' A' ' 37' ' ' LEU . 26.3 mt -126.41 145.75 50.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.483 0.659 . . . . 0.0 112.06 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -114.69 138.87 50.18 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.549 -179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.426 ' HA ' HD21 ' A' ' 35' ' ' LEU . 45.4 t -75.89 140.59 42.25 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 68.3 p -109.89 175.56 5.39 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.145 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.674 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 46.1 t 18.19 60.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.936 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -107.23 -20.76 13.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.799 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.472 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 46.0 t -166.28 69.47 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.444 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.472 ' HA ' ' N ' ' A' ' 55' ' ' SER . 6.6 ptpp? -141.67 31.24 1.66 Allowed 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 122.963 0.505 . . . . 0.0 111.191 0.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -170.72 129.57 0.81 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.276 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.694 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 61.27 166.16 0.1 OUTLIER Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.271 178.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.694 ' HD2' HG22 ' A' ' 58' ' ' VAL . 17.9 Cg_endo -63.62 139.11 68.07 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.25 1.966 . . . . 0.0 112.166 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.1 -39.2 92.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.334 2.022 . . . . 0.0 111.159 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -121.96 89.21 3.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.726 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.601 HD13 HG13 ' A' ' 21' ' ' VAL . 48.9 tp -71.56 -29.01 64.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.202 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.9 m -51.25 -44.43 61.73 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.495 HD11 ' HB3' ' A' ' 38' ' ' ALA . 28.8 pt -72.46 -20.83 19.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.4 m -98.94 13.18 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.75 0.31 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -89.25 129.56 35.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.133 0.492 . . . . 0.0 111.896 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -136.58 162.19 33.8 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.907 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.515 HG22 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.9 132.35 70.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.698 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.402 HD13 ' HB2' ' A' ' 18' ' ' ASP . 16.6 mt -80.47 66.7 6.07 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.479 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.3 mm-40 -46.75 -61.91 1.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -122.58 163.05 20.68 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.793 0.806 . . . . 0.0 112.899 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.6 t -156.1 83.33 1.0 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.819 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 mt -113.17 153.75 27.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.557 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.1 t -67.8 147.12 53.0 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 52.6 t -48.79 -44.64 15.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.106 0.479 . . . . 0.0 110.352 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -57.54 -53.7 55.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.225 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.63 -43.37 97.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.787 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.48 -46.68 89.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.349 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 49.8 mt-30 -66.23 -34.83 78.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.807 0.337 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.9 mtt -63.81 -44.24 93.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.695 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.414 ' O ' HG21 ' A' ' 86' ' ' VAL . 81.4 mt -69.41 -35.03 75.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.81 -35.52 78.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.156 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.6 -24.37 64.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.675 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.6 p -84.22 -5.72 59.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.703 0.287 . . . . 0.0 111.523 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 82' ' ' LEU . 45.3 t -87.69 -53.33 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.279 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.57 -88.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.159 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -148.66 -63.34 0.24 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.894 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.3 t 61.07 176.32 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.212 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -9.37 16.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.66 31.66 81.53 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.752 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 62.49 -82.75 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.441 0.162 . . . . 0.0 111.346 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t 64.0 119.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -79.61 78.24 6.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.045 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.425 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 10.9 p -83.55 -1.3 5.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.455 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.772 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 4.8 mm-40 -53.58 -40.69 65.85 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.772 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 34.2 mtmm -87.17 -51.14 6.16 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 125.059 1.344 . . . . 0.0 111.652 -2.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -58.99 -33.89 71.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.141 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.68 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 32.3 mtmm -62.86 -36.56 83.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.358 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.693 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 37.1 t80 -74.15 -48.0 32.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.885 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.7 ttt -58.31 -37.29 74.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.608 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 45.7 ttm -73.0 -43.86 61.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.827 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.28 -44.14 88.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.915 0.388 . . . . 0.0 110.744 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.2 p -71.29 -40.56 70.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.42 33.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.938 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.581 ' HA ' HE21 ' A' ' 106' ' ' GLN . 0.0 OUTLIER -62.94 -47.15 84.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.89 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.75 -27.12 70.62 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.609 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -71.66 104.91 1.54 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.564 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.685 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . -77.24 177.85 52.11 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.411 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.685 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 77.2 m-70 55.1 32.37 18.17 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.953 1.377 . . . . 0.0 112.29 0.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -107.54 148.13 29.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.072 0.463 . . . . 0.0 111.477 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.0 m -78.71 148.2 33.16 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.124 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.19 132.47 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.672 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.2 mt -116.89 143.78 45.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.215 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -63.88 133.74 53.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.09 0.472 . . . . 0.0 110.469 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.89 -12.44 64.14 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.996 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.98 139.9 33.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.069 0.462 . . . . 0.0 111.509 -179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -82.13 126.51 32.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.7 pt -111.45 160.93 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.536 0.684 . . . . 0.0 112.773 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.1 tp -116.97 108.97 16.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.866 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.5 mt -96.44 117.72 31.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.613 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.515 ' NH2' HG22 ' A' ' 68' ' ' VAL . 46.8 ttp85 -103.25 116.77 33.09 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.758 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.469 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.1 t-80 -59.98 106.48 0.51 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 40.3 t -50.76 -44.99 58.68 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.469 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 49.2 t80 -64.85 -60.58 2.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.457 ' OG ' HD11 ' A' ' 149' ' ' LEU . 58.3 p -77.1 -14.53 59.79 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.26 -0.29 48.67 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.233 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -83.78 -165.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.469 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -134.42 140.33 46.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.408 HD11 HD23 ' A' ' 37' ' ' LEU . 25.9 tp -55.12 125.91 22.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.2 t -135.2 149.39 49.9 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.1 t -95.91 97.79 9.91 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.518 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.6 mt -74.18 151.26 40.04 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.681 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 76.2 p -80.79 6.06 14.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.866 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 77.5 p -93.66 123.03 36.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.0 110.986 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t -65.9 -60.43 2.87 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.806 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -172.09 -78.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.1 m -158.85 -30.2 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.972 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.9 m -87.78 179.9 6.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.044 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 75.5 p -73.42 -18.97 61.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.94 146.83 53.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.734 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -112.78 -89.45 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.33 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 55.32 -89.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.005 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.03 148.0 23.44 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.296 0.57 . . . . 0.0 111.633 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.518 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.8 m-85 -99.41 169.82 9.06 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.218 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -89.23 140.74 29.18 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.712 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.0 t -110.39 117.66 55.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.57 -147.81 5.76 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.73 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 77.2 mt -117.93 148.6 42.02 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.935 0.397 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -141.67 139.38 32.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.803 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.1 -72.91 0.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.16 149.29 45.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 73.9 p -109.98 -2.8 16.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.2 p -54.84 116.81 2.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.69 -159.36 18.32 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.591 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.527 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.4 mt-10 -120.42 -10.06 9.35 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.809 0.338 . . . . 0.0 111.141 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.03 -31.95 67.5 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.8 m -93.93 9.52 37.1 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -110.49 131.48 55.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.094 0.473 . . . . 0.0 111.409 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.446 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.7 m95 -126.7 116.43 20.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.579 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 9.6 p -78.93 127.39 31.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.24 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . 0.411 HD11 HG23 ' A' ' 175' ' ' VAL . 3.6 pt -88.72 135.21 26.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -128.22 150.17 73.28 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.158 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.651 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.6 Cg_endo -67.36 139.85 51.01 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.668 2.245 . . . . 0.0 112.153 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.25 -44.93 58.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.697 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.411 ' HB3' HE21 ' A' ' 168' ' ' GLN . 51.0 m -110.98 -171.83 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.249 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.531 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -91.88 11.26 25.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.227 -179.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.531 HE22 ' HE2' ' A' ' 167' ' ' LYS . 7.3 mm-40 -84.74 -34.59 22.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.112 0.482 . . . . 0.0 110.437 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.651 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.5 mmp_? -92.57 147.21 23.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.14 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 31.3 t -126.52 166.46 17.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.826 0.346 . . . . 0.0 111.298 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.56 131.66 46.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.463 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.87 -14.13 65.9 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.146 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.6 mt-10 -70.51 154.86 41.43 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 111.134 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -70.75 143.75 51.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.411 HG23 HD11 ' A' ' 162' ' ' ILE . 98.2 t -94.02 110.86 24.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.432 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -73.71 153.04 40.23 Favored 'General case' 0 CA--C 1.5 -0.974 0 CA-C-O 121.308 0.575 . . . . 0.0 111.409 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 38.7 t -68.69 121.4 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 176.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.4 -15.26 32.69 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.172 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.05 127.58 32.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 120.833 0.349 . . . . 0.0 110.9 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.461 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -68.92 112.25 5.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.409 HD21 HG13 ' A' ' 175' ' ' VAL . 65.3 mt -98.77 149.02 23.3 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.836 0.827 . . . . 0.0 113.166 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.468 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.8 mt -114.57 112.97 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.97 138.98 31.0 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.1 0.476 . . . . 0.0 111.988 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.426 HG23 ' CD1' ' A' ' 191' ' ' TYR . 69.9 t -130.77 123.27 54.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.0 t -63.04 122.09 15.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.527 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 79.2 t -65.44 -34.46 70.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 120.806 0.336 . . . . 0.0 111.253 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.9 p -78.03 -39.65 41.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.494 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 49.2 m -113.22 9.63 18.44 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 188' ' ' SER . 0.0 OUTLIER 43.56 30.7 0.37 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.718 0.636 . . . . 0.0 112.587 179.257 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.489 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 32.5 mtt85 -111.79 141.4 45.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.939 -179.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.484 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 61.3 m-85 -73.0 153.41 40.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.8 tp -75.61 75.65 2.62 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 175.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -75.2 151.63 38.45 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -174.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.541 HD12 ' HG ' ' A' ' 24' ' ' CYS . 12.9 tp -101.43 119.44 38.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.559 176.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 35.5 p -113.51 146.73 39.17 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.09 89.61 3.12 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.23 -174.75 43.88 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.214 -0.994 . . . . 0.0 111.515 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.6 m-80 1.11 -78.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.421 0.688 . . . . 0.0 112.417 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 48.9 m -147.09 10.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.099 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.6 p -125.37 -178.85 4.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.941 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.418 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.0 m95 -107.49 135.3 49.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.273 0.559 . . . . 0.0 111.175 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.455 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 25.0 m-70 -126.95 172.72 10.21 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.23 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.32 132.8 70.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.121 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.408 ' OD1' ' HB1' ' A' ' 206' ' ' ALA . 2.8 p30 -150.74 170.52 19.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.549 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.484 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.38 96.34 8.3 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.408 ' HB1' ' OD1' ' A' ' 204' ' ' ASP . . . -114.38 -179.46 3.64 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.403 -177.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.6 8.36 28.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.283 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -117.21 137.28 52.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.569 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.468 ' NE2' HD13 ' A' ' 182' ' ' ILE . 94.4 mt-30 -64.63 174.51 1.75 Allowed 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 122.295 1.045 . . . . 0.0 112.949 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.3 m -166.58 121.16 1.11 Allowed 'General case' 0 N--CA 1.44 -0.975 0 CA-C-N 113.13 -1.85 . . . . 0.0 107.994 178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.3 mt -74.99 128.94 36.76 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.055 0.455 . . . . 0.0 109.89 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.415 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.9 m95 -116.53 147.83 41.42 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.456 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 53.1 m -114.86 99.77 7.73 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.462 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.712 HG22 ' HG ' ' A' ' 22' ' ' LEU . 74.0 t -92.09 101.12 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.842 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.58 142.31 28.68 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.056 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.436 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.42 104.32 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.2 1.933 . . . . 0.0 110.995 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.446 HD13 ' HA ' ' A' ' 217' ' ' ILE . 1.9 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.211 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.585 HE21 ' H ' ' A' ' 13' ' ' PHE . 24.7 tp60 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.749 0.309 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.585 ' H ' HE21 ' A' ' 12' ' ' GLN . 48.0 m-85 -119.35 153.64 34.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.25 123.35 27.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.463 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 10.5 mmm180 -111.56 156.38 21.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.162 0.505 . . . . 0.0 111.396 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.424 ' OG1' ' HB3' ' A' ' 110' ' ' HIS . 7.6 p -67.35 156.62 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.611 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 16' ' ' THR . 8.5 m-20 71.39 -5.05 1.68 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.8 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.2 m-20 -72.68 133.84 44.8 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.684 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.64 121.74 26.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.24 172.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -177.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.555 HG12 HD11 ' A' ' 62' ' ' LEU . 3.5 m -133.32 136.28 55.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.545 -1.207 . . . . 0.0 108.222 176.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.69 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.74 121.96 40.27 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.557 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.452 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.2 mt-30 -118.96 161.31 20.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.375 0.607 . . . . 0.0 111.425 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.94 140.82 24.79 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.497 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.3 m -84.21 120.34 26.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.419 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.61 120.79 42.14 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.01 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.9 m -125.4 129.66 50.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.599 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.408 HG21 ' CD2' ' A' ' 29' ' ' HIS . 15.7 tt -165.21 146.28 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.624 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.408 ' CD2' HG21 ' A' ' 28' ' ' ILE . 43.6 m-70 58.47 44.44 18.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.225 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.41 ' N ' ' HE3' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 60.27 22.23 11.66 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.854 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -127.62 147.5 50.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.482 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -132.75 148.5 52.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.957 0.408 . . . . 0.0 111.179 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -159.47 173.11 16.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -120.66 137.06 54.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.447 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 23' ' ' GLN . 1.9 mt -126.24 141.72 51.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.9 p -104.73 141.83 35.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.022 0.439 . . . . 0.0 110.387 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.3 tp -64.31 109.26 1.84 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.121 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 64' ' ' ILE . . . -107.11 162.69 13.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.545 -179.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.48 164.52 14.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.65 143.21 35.02 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.679 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.84 12.36 42.53 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.267 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -116.72 150.15 38.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.662 0.268 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.88 -138.34 19.27 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.317 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.6 p30 -84.69 11.93 8.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.661 0.267 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.96 29.55 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.269 179.537 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.65 140.85 38.34 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 120.975 0.417 . . . . 0.0 110.626 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.46 152.56 26.05 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.557 0.694 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -146.49 -169.19 3.21 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.581 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -128.06 143.8 51.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.423 0.63 . . . . 0.0 111.964 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -111.98 140.87 46.29 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.651 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.443 ' HA ' HD22 ' A' ' 35' ' ' LEU . 86.0 p -78.54 141.71 37.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 69.1 p -109.36 173.59 6.25 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.219 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.678 ' HB3' ' H ' ' A' ' 58' ' ' VAL . 83.1 p 18.3 59.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.706 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -103.38 -39.29 6.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.766 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.514 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 35.7 t -168.74 66.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.546 ' HZ2' ' HB2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -156.4 155.94 33.0 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.025 0.53 . . . . 0.0 110.979 0.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.527 ' N ' ' HA ' ' A' ' 53' ' ' SER . 6.6 t30 65.98 118.45 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.013 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.705 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 61.2 165.62 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.643 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.705 ' HD2' HG22 ' A' ' 58' ' ' VAL . 18.1 Cg_endo -64.1 138.05 60.05 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.326 2.017 . . . . 0.0 112.044 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.414 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.2 Cg_endo -52.84 -37.86 77.56 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.29 1.993 . . . . 0.0 111.399 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.413 ' O ' HG12 ' A' ' 64' ' ' ILE . 12.8 t70 -124.35 89.06 3.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.658 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.555 HD11 HG12 ' A' ' 21' ' ' VAL . 42.9 tp -72.32 -27.92 62.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.469 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.9 p -53.64 -42.71 68.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 38' ' ' ALA . 27.3 pt -72.18 -17.72 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.5 m -101.92 14.27 32.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.651 0.262 . . . . 0.0 111.226 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.1 m -90.67 128.94 36.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.079 0.466 . . . . 0.0 111.719 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -136.35 159.38 41.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.984 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.504 HG22 ' NH2' ' A' ' 122' ' ' ARG . 3.2 t -123.23 132.56 71.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.716 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 mt -80.06 65.87 5.36 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.466 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 11.2 mm-40 -45.24 -67.09 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.415 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 18.6 mm-40 -118.99 164.48 15.41 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.687 0.756 . . . . 0.0 112.82 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.1 t -157.21 82.59 0.92 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.864 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.62 157.37 19.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.419 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.0 t -69.68 146.82 51.29 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.425 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.6 t -49.38 -46.06 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 16.8 ttp-105 -55.24 -58.53 7.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.097 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -55.05 -46.54 75.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.923 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.3 tp -58.78 -49.32 78.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.243 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 94.7 mt-30 -64.18 -33.21 75.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.754 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -66.99 -42.25 85.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.765 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.8 mtt -63.03 -43.73 97.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.905 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.7 mt -69.71 -35.24 74.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.82 -31.67 71.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.187 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -71.3 -27.37 63.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.496 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 60.3 p -78.1 -10.09 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.77 0.319 . . . . 0.0 111.387 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.8 t -76.79 -21.32 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.663 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -129.77 -166.87 1.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.501 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -57.74 118.76 5.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.822 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 79.3 p -141.02 147.97 39.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.984 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -168.47 115.48 0.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.76 36.99 0.74 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.603 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -78.06 -34.9 50.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.776 0.322 . . . . 0.0 110.971 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 24.0 m -79.24 -170.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.357 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.484 ' HB2' ' HB3' ' A' ' 100' ' ' PHE . 3.9 p-10 -62.32 92.37 0.04 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.42 1.66 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.887 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.763 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.0 mm-40 -53.49 -41.52 66.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.34 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.763 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.1 mttt -88.41 -51.37 5.77 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 125.005 1.322 . . . . 0.0 111.225 -3.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -63.2 -28.36 69.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.724 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 23.9 tptm -63.31 -40.76 98.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.119 -0.633 . . . . 0.0 109.912 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.575 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.4 t80 -74.26 -44.12 54.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.949 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.58 -41.28 76.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.391 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.4 tpt -74.97 -41.15 60.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.992 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.562 ' HB2' ' HZ2' ' A' ' 103' ' ' LYS . 4.0 ttmp? -57.82 -42.82 85.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.942 0.401 . . . . 0.0 110.552 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 77.0 m -72.06 -48.56 43.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.747 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.1 64.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.8 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.02 -55.25 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.65 7.13 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.451 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 54.92 20.31 18.83 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.533 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.528 ' N ' ' HA ' ' A' ' 110' ' ' HIS . . . -55.5 -65.94 3.19 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.844 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.528 ' HA ' ' N ' ' A' ' 109' ' ' GLY . 29.7 t-80 -93.08 -40.41 10.53 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 117.695 0.747 . . . . 0.0 111.315 0.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -157.28 146.98 20.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.077 0.465 . . . . 0.0 111.502 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.463 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 85.6 m -76.25 147.18 38.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.906 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.33 131.12 35.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.756 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.0 mt -115.26 140.9 48.71 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.22 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.568 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 37.8 m-85 -61.45 130.04 44.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.008 0.432 . . . . 0.0 110.341 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.35 -13.06 58.54 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.13 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.51 141.28 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.042 0.449 . . . . 0.0 111.359 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.67 128.29 34.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.097 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 160' ' ' TRP . 41.5 pt -113.39 159.53 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.579 0.704 . . . . 0.0 112.818 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.415 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.5 tp -116.09 110.5 18.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.889 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 mt -97.98 118.01 33.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.469 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.504 ' NH2' HG22 ' A' ' 68' ' ' VAL . 54.4 ttp85 -103.0 116.39 32.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.73 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.3 t-80 -59.29 105.67 0.36 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 177.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 46.9 t -50.28 -45.56 54.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.51 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.5 t80 -64.2 -61.85 1.99 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.459 ' HG ' ' H ' ' A' ' 128' ' ' MET . 53.4 p -76.62 -13.75 60.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 72.82 1.34 54.49 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.172 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.459 ' H ' ' HG ' ' A' ' 126' ' ' SER . 53.9 mtt -84.04 -164.98 1.02 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.466 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 68.9 m-85 -135.42 138.67 43.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.75 126.2 23.11 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 42.1 t -134.69 148.27 50.28 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.6 t -95.21 96.57 9.28 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.525 -1.216 . . . . 0.0 107.758 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.522 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.5 mt -73.96 152.03 40.2 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 89.9 p -83.66 6.41 20.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.083 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.3 p -95.4 121.6 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.724 0.297 . . . . 0.0 111.025 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.402 ' HG ' ' HB3' ' A' ' 141' ' ' ASP . 47.4 t -62.82 -57.06 12.19 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.772 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -166.24 -33.55 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.643 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.4 t -157.23 111.28 2.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.935 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.5 t 58.13 23.13 9.82 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.011 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.8 m 65.85 136.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.309 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.402 ' HB3' ' HG ' ' A' ' 136' ' ' SER . 17.9 t70 -137.84 -86.58 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.868 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.601 ' HG2' ' H ' ' A' ' 143' ' ' LEU . 35.5 tttm -178.23 -170.3 0.22 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.751 0.31 . . . . 0.0 110.814 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.601 ' H ' ' HG2' ' A' ' 142' ' ' LYS . 4.3 mm? 60.09 -108.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.804 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.96 145.74 25.87 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.401 0.62 . . . . 0.0 112.321 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.2 m-85 -101.73 170.54 8.1 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.887 -1.051 . . . . 0.0 108.98 178.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.35 142.47 27.7 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 67.7 t -112.71 117.22 54.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.344 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.06 -146.89 5.54 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.844 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 73.1 mt -117.92 152.61 35.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.838 0.352 . . . . 0.0 110.531 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -142.32 140.1 32.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.66 -46.37 46.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.463 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -87.17 143.3 27.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 72.2 p -105.83 -8.54 17.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -53.23 114.44 1.47 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.513 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.91 -155.39 20.19 Favored Glycine 0 N--CA 1.441 -1.028 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.614 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.478 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -123.04 -13.94 7.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.704 0.288 . . . . 0.0 111.362 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.53 -32.99 67.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 74.3 m -90.47 8.14 35.33 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -111.55 132.26 54.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.055 0.455 . . . . 0.0 111.486 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.416 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.9 m95 -126.75 118.41 24.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.661 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -80.08 126.59 31.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.98 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.2 pt -88.19 135.8 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -128.77 150.72 75.72 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.253 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.621 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.16 138.87 53.33 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.585 2.19 . . . . 0.0 112.349 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.19 -40.29 45.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.557 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 96.0 p -109.05 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.6 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.76 5.05 53.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.655 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -85.48 -29.56 24.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.041 0.448 . . . . 0.0 110.866 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.621 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 73.9 mmt-85 -92.11 146.71 23.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.374 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 45.1 t -129.52 167.55 17.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.322 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.24 136.19 56.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.376 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.48 -15.91 55.15 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.459 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 170' ' ' SER . 30.8 mt-10 -68.36 155.48 39.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.026 0.441 . . . . 0.0 111.254 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -73.38 141.47 47.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.43 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 98.1 t -91.07 123.1 43.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.375 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.58 HH11 ' H ' ' A' ' 12' ' ' GLN . 28.9 mmt180 -87.69 154.67 20.4 Favored 'General case' 0 CA--C 1.496 -1.126 0 CA-C-O 121.266 0.555 . . . . 0.0 111.405 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.76 120.95 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.62 -11.63 30.3 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.907 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -72.21 126.73 30.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.75 0.309 . . . . 0.0 110.779 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.4 m-20 -69.49 115.5 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 73.9 mt -100.31 148.26 24.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.763 0.792 . . . . 0.0 112.961 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.44 HD12 ' NE2' ' A' ' 209' ' ' GLN . 57.6 mt -113.49 112.75 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 176.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.4 mp -93.16 139.45 30.58 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.073 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.421 HG23 ' CD1' ' A' ' 191' ' ' TYR . 71.4 t -130.8 127.8 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.718 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 4.3 m -65.05 124.95 23.44 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.478 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 94.2 t -69.1 -32.07 52.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.716 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.88 -36.2 36.9 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 61.3 m -116.64 4.9 13.17 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -177.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.15 31.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.466 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 30.0 mtt85 -112.25 141.69 45.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.2 m-85 -72.88 152.92 41.24 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.5 tp -75.11 76.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -76.88 150.12 36.04 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.1 tp -99.87 119.09 37.66 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.627 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 55.6 p -113.48 147.7 37.36 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -107.0 90.8 3.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -174.49 45.7 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.411 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 18.0 m120 0.6 -78.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.397 0.679 . . . . 0.0 112.449 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 57.4 m -147.68 12.85 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.126 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 54.6 m -126.9 -178.14 4.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -107.88 134.44 50.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.175 0.512 . . . . 0.0 111.158 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.457 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 27.6 m-70 -126.46 172.46 10.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.1 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.93 131.59 70.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.237 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 206' ' ' ALA . 2.9 p30 -148.73 172.09 15.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.655 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.25 95.54 7.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.022 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.415 ' HB2' ' OD1' ' A' ' 204' ' ' ASP . . . -113.9 -179.03 3.52 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.299 -177.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -88.61 7.94 30.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.17 138.33 51.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.584 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.44 ' NE2' HD12 ' A' ' 182' ' ' ILE . 96.4 mt-30 -68.37 173.41 4.9 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.274 1.035 . . . . 0.0 112.828 -178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -164.79 120.4 1.43 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 113.121 -1.854 . . . . 0.0 107.843 178.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.5 mt -73.89 127.52 33.06 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.47 -0.492 . . . . 0.0 109.943 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.412 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.76 140.92 48.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.731 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.2 t -107.9 100.45 9.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.55 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.69 HG22 ' HG ' ' A' ' 22' ' ' LEU . 65.0 t -92.16 102.93 14.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.781 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.27 142.09 28.13 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.349 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.433 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.2 Cg_exo -63.54 103.99 0.42 Allowed 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.218 1.946 . . . . 0.0 111.165 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.449 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.0 mm . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.295 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 120.728 0.299 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.403 ' HB3' HG23 ' A' ' 112' ' ' THR . 68.6 m-85 -116.67 154.58 30.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.332 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.1 mt -76.91 120.61 22.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.411 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.7 mmm180 -109.87 156.19 20.71 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.066 0.46 . . . . 0.0 111.217 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.42 ' C ' ' H ' ' A' ' 18' ' ' ASP . 11.0 p -67.1 157.68 33.01 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 70.53 -4.71 1.57 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 16' ' ' THR . 4.6 m-20 -72.28 133.01 44.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.75 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -79.53 119.84 23.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.477 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.1 m -137.06 172.41 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.666 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 5.4 m -132.71 137.55 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.368 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.68 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.7 mp -97.8 120.66 38.59 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.854 -0.339 . . . . 0.0 110.535 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -119.0 159.68 23.41 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.416 0.627 . . . . 0.0 111.521 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.9 p -146.24 140.76 26.78 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.563 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -83.35 124.09 30.29 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.405 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.443 ' HB1' HD13 ' A' ' 35' ' ' LEU . . . -116.18 118.5 32.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.914 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.9 m -122.4 136.56 54.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.736 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 tt -176.0 143.84 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.781 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.3 m80 58.03 42.51 22.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.391 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 60.03 22.02 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.426 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -127.19 129.67 48.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.704 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -121.72 144.45 48.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.022 0.439 . . . . 0.0 111.18 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -155.37 175.58 13.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.806 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.465 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 23.9 mtmm -122.36 136.63 54.93 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.561 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.443 HD13 ' HB1' ' A' ' 26' ' ' ALA . 1.5 mt -126.51 141.28 51.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.64 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.579 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.7 t -105.08 144.8 31.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.976 0.417 . . . . 0.0 110.633 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.441 ' HA ' HD21 ' A' ' 49' ' ' LEU . 34.7 tp -64.01 115.34 4.82 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.817 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.418 ' HB1' HD13 ' A' ' 64' ' ' ILE . . . -114.0 163.83 14.62 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.56 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.04 166.83 10.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.753 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.3 144.46 32.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.439 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.63 14.94 38.76 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.288 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -117.64 146.76 43.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.8 0.333 . . . . 0.0 110.693 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -135.24 14.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.538 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -84.3 9.33 13.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.629 0.252 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.59 30.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.177 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.68 139.54 38.49 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.093 0.473 . . . . 0.0 110.712 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.5 m -80.67 152.62 28.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -146.96 -163.91 1.87 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.436 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 37' ' ' LEU . 23.0 mt -131.28 140.71 49.84 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 112.203 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -107.89 137.92 45.04 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.673 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.416 ' HA ' HD22 ' A' ' 35' ' ' LEU . 49.3 m -78.31 142.62 37.62 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.505 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 71.6 p -105.55 157.67 17.22 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.362 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 20.8 t -51.29 -17.69 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.323 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.1 m120 61.78 25.96 15.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.402 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.5 m -146.22 68.85 1.19 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.355 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -82.5 -19.45 38.71 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.043 0.537 . . . . 0.0 110.453 -0.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.505 ' C ' ' HB ' ' A' ' 52' ' ' THR . 0.8 OUTLIER -158.14 -103.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.213 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.4 t 60.79 100.49 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HG3' HG21 ' A' ' 52' ' ' THR . 6.7 Cg_exo -75.12 139.34 23.87 Favored 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 123.17 2.58 . . . . 0.0 111.211 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -50.43 -36.95 50.21 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.364 2.042 . . . . 0.0 111.641 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -122.52 82.78 2.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.682 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.568 HD12 HG12 ' A' ' 21' ' ' VAL . 42.0 tp -64.62 -30.76 71.79 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.1 p -48.83 -52.65 23.02 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.418 HD13 ' HB1' ' A' ' 38' ' ' ALA . 31.0 pt -69.94 -15.14 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.666 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.95 -1.87 38.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.2 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.7 m -84.17 134.01 34.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 0.0 112.199 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -138.2 161.38 37.0 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.952 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.484 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.5 t -125.82 132.12 71.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.727 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.83 64.5 5.63 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.472 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 14.2 mm-40 -43.3 -62.83 0.94 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -178.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -124.74 164.33 20.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.744 0.783 . . . . 0.0 112.716 -177.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.3 t -156.29 84.08 0.99 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.387 -1.279 . . . . 0.0 108.888 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -112.99 154.94 25.67 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.397 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 81.9 p -67.68 150.21 49.01 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.465 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 43.2 t -52.69 -41.94 39.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.055 0.455 . . . . 0.0 110.274 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.9 ttp85 -59.98 -51.44 69.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.13 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.65 91.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.745 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.5 tp -64.18 -44.17 92.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.862 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 44.8 mt-30 -67.92 -35.42 78.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.964 0.411 . . . . 0.0 110.469 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.54 -42.33 92.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.704 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.7 mtt -64.7 -44.1 91.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.79 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.42 -35.21 80.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.098 0.475 . . . . 0.0 110.374 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -35.4 77.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.98 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -77.68 -17.66 57.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.556 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.1 p -89.19 5.58 44.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.877 0.37 . . . . 0.0 111.252 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.2 t -83.84 -31.38 8.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.333 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -87.97 -28.2 21.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.955 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -132.55 139.26 47.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 77.8 p -118.95 16.41 13.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.084 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -123.1 141.04 52.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.995 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.03 37.36 0.76 Allowed Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.782 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -98.78 -71.08 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.673 0.273 . . . . 0.0 111.261 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 17.4 m -57.5 151.9 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.623 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.54 81.51 8.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.539 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.441 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.9 p -81.29 0.71 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.688 -179.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.77 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.1 OUTLIER -53.96 -38.77 65.33 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.77 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.5 mttt -88.18 -52.02 5.46 Favored 'General case' 0 C--N 1.352 0.684 0 CA-C-N 120.431 1.469 . . . . 0.0 111.529 -3.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -65.85 -28.76 69.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.033 -1.44 . . . . 0.0 113.071 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 75.7 mmtt -59.51 -48.96 79.62 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.139 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.595 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 74.3 t80 -73.96 -39.53 63.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.564 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.5 ttm -59.87 -38.09 81.2 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.573 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.17 -46.93 30.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.675 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -58.01 -43.83 86.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 62.9 m -72.07 -45.72 59.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.49 -56.56 18.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.288 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -70.66 -35.33 72.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.265 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.68 -66.04 3.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.695 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.68 -84.94 0.17 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.665 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.502 ' HA2' ' HB3' ' A' ' 110' ' ' HIS . . . 152.87 -179.73 29.08 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.502 ' HB3' ' HA2' ' A' ' 109' ' ' GLY . 4.1 t60 56.37 42.38 27.76 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.953 1.377 . . . . 0.0 111.697 -0.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -125.55 140.22 52.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.198 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.408 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 88.8 m -71.28 146.36 48.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.348 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.39 133.31 35.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.419 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.56 142.31 47.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.994 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.547 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.6 m-85 -63.25 124.45 21.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.132 0.491 . . . . 0.0 110.484 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.94 -13.64 41.21 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.887 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.48 141.31 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.993 0.425 . . . . 0.0 111.328 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.25 128.45 34.2 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.3 pt -113.01 159.36 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.579 0.704 . . . . 0.0 112.833 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.1 tp -115.42 109.29 17.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.834 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -97.5 116.86 30.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.696 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.484 ' NH2' HG21 ' A' ' 68' ' ' VAL . 61.8 ttp85 -102.67 116.51 32.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.706 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.461 ' HD1' ' CB ' ' A' ' 126' ' ' SER . 19.5 t-80 -59.88 106.78 0.53 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 41.5 m -52.06 -43.45 63.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 56.4 t80 -66.0 -58.67 5.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.461 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 20.0 m -79.12 -13.3 59.82 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . 0.422 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 72.18 -0.85 37.13 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.307 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.2 mtt -83.24 -165.47 1.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.472 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -133.94 139.0 45.84 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 23.5 tp -55.77 124.95 19.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.1 t -133.36 148.08 51.84 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -176.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -94.19 98.76 11.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.513 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.1 mt -76.91 147.34 37.06 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.578 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -78.89 6.22 9.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.911 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.9 p -92.2 124.1 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t -62.85 -60.6 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.879 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.1 tpt180 -176.76 -61.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.0 p -142.4 23.99 1.95 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.573 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.3 m 59.12 88.88 0.06 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.79 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.1 t -170.14 -24.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.143 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -143.63 -179.09 6.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.677 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -139.79 16.07 2.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.339 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.75 -73.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.938 0.399 . . . . 0.0 110.32 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -115.12 154.59 28.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.008 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.7 m-85 -99.87 171.09 8.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.272 178.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -90.17 143.59 26.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.031 0.443 . . . . 0.0 109.935 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.21 116.0 51.38 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.311 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.64 -151.75 6.61 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.91 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.447 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 46.3 mt -113.51 149.14 34.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -140.38 140.06 35.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.69 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -74.17 -49.4 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.551 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.01 143.85 30.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.834 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.5 p -106.47 -7.81 17.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.707 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.3 p -52.88 114.96 1.6 Allowed 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.636 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.75 -157.04 19.67 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.712 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.49 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -120.16 -13.9 8.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.759 0.314 . . . . 0.0 111.338 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 68.4 m -90.63 8.05 36.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -110.84 132.58 54.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.042 0.449 . . . . 0.0 111.241 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.427 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.4 m95 -127.03 116.23 20.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.721 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.3 p -78.3 125.18 28.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.7 pt -86.92 136.66 22.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.844 0.354 . . . . 0.0 110.918 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.5 m80 -128.58 149.04 70.76 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.095 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.59 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 33.9 Cg_endo -65.31 137.07 49.93 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.455 2.103 . . . . 0.0 112.511 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -78.22 -40.1 38.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.426 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 78.4 p -105.95 -171.21 1.86 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.406 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -95.03 -7.25 40.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.408 ' NE2' ' N ' ' A' ' 168' ' ' GLN . 1.7 mp0 -72.99 -32.39 65.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.022 0.439 . . . . 0.0 110.883 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.59 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.2 mmp_? -90.25 146.66 24.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.499 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.2 m -130.15 167.22 18.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.126 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -66.77 128.79 37.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.337 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 96.11 -13.55 65.76 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -70.55 156.39 39.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.045 0.45 . . . . 0.0 111.283 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -73.91 139.67 45.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.456 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.1 t -89.7 119.53 36.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.213 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.8 153.71 23.93 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 121.246 0.546 . . . . 0.0 111.516 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 13.6 t -68.6 118.31 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.67 -8.01 29.97 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.276 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.14 136.34 44.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.79 0.329 . . . . 0.0 110.802 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.516 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 38.6 m-20 -76.98 114.2 15.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.457 HD13 HG22 ' A' ' 214' ' ' VAL . 64.4 mt -99.64 149.25 23.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.755 0.788 . . . . 0.0 112.955 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.469 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 66.3 mt -114.62 112.17 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 176.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -91.8 139.44 30.67 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.089 0.471 . . . . 0.0 112.156 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.431 HG21 ' CD1' ' A' ' 191' ' ' TYR . 72.7 t -131.88 121.74 47.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.902 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 95.6 p -61.42 120.27 10.15 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.49 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 91.7 t -63.38 -34.03 64.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.319 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.6 p -77.73 -39.33 44.84 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.432 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.7 m -113.71 7.39 17.18 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.39 31.29 1.24 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.446 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 22.1 mtt180 -112.7 140.65 47.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.96 0.409 . . . . 0.0 110.812 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 50.8 m-85 -72.91 152.97 41.2 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 37.4 tp -74.92 77.56 2.16 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 175.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -77.5 150.61 34.84 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -174.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.409 HD13 ' CE3' ' A' ' 201' ' ' TRP . 12.0 tp -100.43 117.81 35.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.589 176.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 43.0 t -111.32 145.7 38.36 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.45 90.17 3.33 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.524 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.37 -175.55 45.49 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.432 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' A' ' 197' ' ' GLY . 9.9 m120 1.16 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.449 0.7 . . . . 0.0 112.459 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 77.3 p -146.13 10.62 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.153 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 67.3 p -125.23 -177.88 4.02 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.992 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 91.6 m95 -108.23 137.3 46.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 111.206 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.462 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 26.4 m-70 -129.22 172.47 11.42 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.027 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.54 134.7 65.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.246 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -153.06 170.93 19.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.509 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.06 94.47 6.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -112.82 178.18 4.38 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.402 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -86.41 10.97 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -119.5 136.83 54.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -65.07 176.3 1.31 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 122.399 1.095 . . . . 0.0 113.143 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.5 m -169.28 120.43 0.72 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 112.946 -1.933 . . . . 0.0 107.729 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.516 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 22.4 mt -74.6 127.58 33.44 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.041 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.419 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.7 m95 -114.34 141.82 47.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.733 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.3 t -108.87 100.44 9.65 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.524 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.68 HG21 ' HG ' ' A' ' 22' ' ' LEU . 86.8 t -91.82 102.13 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.682 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.87 141.96 27.65 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.233 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.412 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.76 104.46 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.033 1.822 . . . . 0.0 111.316 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.477 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.202 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -118.82 153.31 34.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.811 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 34.4 mt -79.58 122.32 26.35 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.8 mmm180 -110.17 157.3 19.54 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.018 0.437 . . . . 0.0 111.272 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.42 ' HG1' ' H ' ' A' ' 111' ' ' ARG . 7.6 p -67.79 155.22 39.82 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.889 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.66 -7.89 1.49 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.624 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.1 m-20 -69.15 137.94 53.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.767 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -84.39 119.38 25.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.0 m -136.15 170.03 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.686 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.4 m -132.14 139.65 49.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.414 176.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.67 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.7 mp -100.58 119.72 38.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.7 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 43.6 mt-30 -117.6 163.34 16.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 121.298 0.57 . . . . 0.0 111.374 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.25 144.24 25.46 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.2 m -87.41 123.29 32.2 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.621 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -115.04 121.18 42.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.885 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.5 m -124.73 132.91 53.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.714 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.3 tt -172.0 148.88 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.644 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.3 m80 58.75 41.44 21.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.43 21.93 11.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.39 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -126.34 150.12 48.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.534 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -135.38 146.47 48.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.91 0.386 . . . . 0.0 110.839 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.558 ' NE2' HD21 ' A' ' 35' ' ' LEU . 9.1 pt20 -158.37 172.01 19.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.763 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -118.7 137.09 53.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.534 178.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.558 HD21 ' NE2' ' A' ' 33' ' ' GLN . 2.2 mt -127.37 140.75 51.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.746 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 53.6 t -104.47 146.97 28.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.926 0.393 . . . . 0.0 110.259 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HA ' HD22 ' A' ' 49' ' ' LEU . 32.9 tp -66.57 112.23 4.03 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.799 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.32 163.72 13.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.436 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.01 162.72 15.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.912 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.71 144.02 45.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.68 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.55 18.81 31.76 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.167 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -124.33 146.57 48.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.841 0.353 . . . . 0.0 110.607 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.15 -137.65 18.78 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.434 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -80.89 7.76 9.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.655 0.264 . . . . 0.0 110.922 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.445 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.18 32.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.046 179.669 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.1 mt -78.72 135.43 37.15 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.982 0.42 . . . . 0.0 110.693 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -75.57 150.35 38.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.569 0.699 . . . . 0.0 111.33 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -144.39 -165.84 2.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.502 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' A' ' 37' ' ' LEU . 35.0 mt -129.99 143.6 50.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.395 0.617 . . . . 0.0 112.238 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -111.93 137.37 50.02 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.674 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.533 ' HA ' HD22 ' A' ' 35' ' ' LEU . 84.6 p -76.12 145.06 40.26 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.514 HG21 ' HG3' ' A' ' 59' ' ' PRO . 76.0 p -107.96 174.25 5.96 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.399 -0.521 . . . . 0.0 111.756 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.61 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 47.3 t 18.4 58.95 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 114.242 -1.345 . . . . 0.0 112.733 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -96.92 -20.98 17.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.625 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.542 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 77.2 p -169.46 66.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.408 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.542 ' HA ' ' N ' ' A' ' 55' ' ' SER . 23.6 pttm -149.56 37.81 0.75 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 122.882 0.473 . . . . 0.0 111.305 0.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.422 ' N ' ' HA ' ' A' ' 53' ' ' SER . 51.4 t30 -167.44 125.23 1.24 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.388 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.61 ' H ' ' HB2' ' A' ' 53' ' ' SER . 0.5 OUTLIER 61.55 167.22 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.52 178.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.591 ' HD2' HG23 ' A' ' 58' ' ' VAL . 22.7 Cg_exo -58.67 139.39 90.51 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.162 1.908 . . . . 0.0 111.643 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.12 -38.76 94.37 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.172 1.915 . . . . 0.0 111.228 179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -123.76 90.39 3.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.668 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.575 HD13 HG12 ' A' ' 21' ' ' VAL . 46.4 tp -68.91 -28.93 67.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.386 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.9 m -48.43 -49.64 34.38 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.446 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.7 pt -72.67 -16.92 18.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.856 -179.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.686 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -99.09 -1.07 40.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.409 -178.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.3 m -86.18 132.2 34.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 112.187 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -136.41 161.51 35.62 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.043 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.477 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.41 133.66 68.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.751 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 HG12 ' A' ' 20' ' ' VAL . 17.9 mt -82.34 65.59 7.55 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 14.4 mm-40 -44.42 -63.91 0.79 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.401 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.4 mm100 -123.78 164.74 18.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.69 0.757 . . . . 0.0 112.742 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.21 86.98 1.03 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.068 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.42 HD12 ' SD ' ' A' ' 81' ' ' MET . 4.2 mt -113.73 156.08 24.44 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.138 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.8 t -69.19 149.35 48.69 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.465 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 49.6 t -51.34 -44.4 31.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.074 0.464 . . . . 0.0 110.361 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.4 ttp-105 -56.99 -57.04 14.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.985 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.42 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -58.14 -43.17 87.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.633 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.36 -48.02 83.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.076 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 44.8 mt-30 -64.32 -36.2 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.007 0.432 . . . . 0.0 110.584 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.9 -42.08 95.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.033 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.9 mtt -65.43 -43.15 91.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.992 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.44 -31.81 71.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.972 0.415 . . . . 0.0 110.528 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.74 -33.33 70.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.666 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -78.05 -16.33 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.532 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.5 p -89.11 -2.05 58.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.797 0.332 . . . . 0.0 111.507 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.33 -22.56 19.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.316 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -61.27 -74.1 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -136.79 -61.85 0.66 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 81.1 p -159.6 -175.41 5.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.757 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.558 ' HG2' ' H ' ' A' ' 92' ' ' GLN . 0.2 OUTLIER -103.04 -33.05 9.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.042 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.6 33.48 85.09 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.535 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.558 ' H ' ' HG2' ' A' ' 90' ' ' GLU . 44.4 mt-30 -112.5 7.86 19.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.807 0.337 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.0 m -64.92 179.94 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.369 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.469 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 6.4 m-20 -71.82 88.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.471 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.88 -10.34 11.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.766 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.694 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 25.1 mm-40 -53.08 -44.89 67.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.723 -179.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.694 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 16.6 ptpt -86.66 -49.63 7.37 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.21 1.404 . . . . 0.0 111.304 -3.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -54.19 -41.48 68.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.854 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.6 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 66.1 tttp -59.56 -31.07 69.08 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.95 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.676 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.1 t80 -73.3 -44.94 58.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.43 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 68.1 mmm -56.79 -46.96 81.21 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.07 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 57.2 ttp -68.84 -42.82 76.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.336 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -57.68 -45.8 85.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.849 0.356 . . . . 0.0 110.856 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.428 HG21 ' HA3' ' A' ' 108' ' ' GLY . 36.5 m -68.54 -43.54 76.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.846 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.59 72.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.859 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -69.77 -54.29 14.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -163.04 70.48 0.21 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.751 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.428 ' HA3' HG21 ' A' ' 104' ' ' THR . . . -71.68 5.83 10.52 Favored Glycine 0 CA--C 1.518 0.261 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.493 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.91 -151.94 0.88 Allowed Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.449 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -134.75 150.87 50.62 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.019 0.909 . . . . 0.0 110.679 -0.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.42 ' H ' ' HG1' ' A' ' 16' ' ' THR . 11.7 ptp180 -166.15 142.71 5.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.095 0.474 . . . . 0.0 111.315 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.437 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 80.9 m -74.25 147.18 42.65 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.53 130.48 35.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -114.95 141.66 47.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.159 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.94 125.4 23.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 105.17 -12.28 48.49 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.121 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.41 142.29 32.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.081 0.467 . . . . 0.0 111.237 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.92 126.41 32.45 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.5 pt -112.19 159.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.401 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 19.1 tp -114.38 109.24 18.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.877 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.3 mt -97.11 116.22 28.92 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.779 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.477 ' NH2' HG21 ' A' ' 68' ' ' VAL . 58.7 ttp85 -101.86 116.5 32.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.715 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.459 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.4 t-80 -59.8 106.22 0.46 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 62.0 m -49.18 -46.5 45.6 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.459 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 63.3 t80 -64.06 -64.26 0.94 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.458 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 14.7 m -72.69 -14.79 61.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.1 -1.45 40.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.179 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 49.3 mtt -82.01 -165.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.525 0.203 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.478 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 66.6 m-85 -134.6 138.69 44.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.1 tp -54.99 126.14 23.34 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.4 t -134.71 147.77 50.15 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . 0.524 ' HG ' ' HB2' ' A' ' 188' ' ' SER . 53.0 t -95.48 98.12 10.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.0 mt -75.02 149.54 39.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -80.84 5.96 14.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.783 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.8 p -90.32 122.83 33.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.737 0.303 . . . . 0.0 111.074 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 48.9 m -64.63 -60.59 2.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.8 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -176.62 -60.2 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.672 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.7 p -159.56 -46.16 0.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.527 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.7 p -101.05 -161.64 0.88 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.591 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 38.2 p -57.26 -72.65 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.372 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.438 ' C ' ' H ' ' A' ' 143' ' ' LEU . 18.0 m-20 59.28 -83.86 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 74.68 -20.88 0.31 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.55 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.438 ' H ' ' C ' ' A' ' 141' ' ' ASP . 4.6 mm? -60.24 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.772 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -102.17 149.0 24.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.531 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -100.83 170.79 8.08 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.166 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -89.43 143.76 26.57 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 120.995 0.426 . . . . 0.0 109.949 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.4 t -113.49 118.0 56.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.312 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.48 -148.43 5.51 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.98 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 52.2 mt -115.92 151.29 35.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.077 0.465 . . . . 0.0 110.831 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -141.15 139.94 34.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.579 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -73.35 -52.87 12.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -82.57 147.05 28.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 58.2 p -105.49 -5.03 20.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -55.74 113.08 1.33 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.453 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.47 -159.61 21.45 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.593 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.449 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 36.5 mt-10 -118.79 -13.26 9.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.808 0.337 . . . . 0.0 111.428 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.94 -32.88 66.44 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 64.9 m -91.17 7.19 41.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.19 133.98 52.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.016 0.436 . . . . 0.0 111.253 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.414 ' O ' HG12 ' A' ' 119' ' ' ILE . 57.3 m95 -128.8 117.72 21.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.822 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.424 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 13.6 p -79.08 125.65 29.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.112 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.3 pt -88.01 136.11 23.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.94 0.4 . . . . 0.0 110.943 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -128.76 151.41 77.15 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.305 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.646 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.1 Cg_endo -67.51 140.93 53.81 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.598 2.199 . . . . 0.0 112.274 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -44.52 53.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.847 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -110.8 -170.85 1.72 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.248 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.519 ' HE3' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -92.44 9.26 35.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.149 -179.819 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.519 HE22 ' HE3' ' A' ' 167' ' ' LYS . 9.9 mm-40 -83.03 -35.25 25.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.548 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.646 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 77.3 mmt-85 -91.96 146.56 23.64 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.299 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 46.1 t -123.95 165.52 17.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.398 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.18 129.46 40.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.23 -13.53 64.54 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.851 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.49 156.09 39.83 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 37.6 mttp -72.81 140.51 47.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -90.25 120.06 38.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.534 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -83.85 155.64 22.83 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 121.344 0.593 . . . . 0.0 111.533 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 25.0 t -71.13 120.33 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.08 -11.69 31.67 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.167 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -70.67 129.82 40.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.742 0.306 . . . . 0.0 110.907 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.558 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.5 m-20 -71.41 114.81 9.87 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.534 HD13 HG22 ' A' ' 214' ' ' VAL . 69.2 mt -100.43 148.11 25.11 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 50.7 mt -113.64 113.39 43.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 176.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -93.12 137.1 32.77 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.167 0.508 . . . . 0.0 112.107 -178.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.424 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 78.7 t -129.14 121.1 53.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.456 ' HG ' ' HB2' ' A' ' 188' ' ' SER . 86.5 p -61.31 124.19 19.9 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.449 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.6 t -67.81 -32.25 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.172 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 98.2 p -77.52 -37.75 50.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.524 ' HB2' ' HG ' ' A' ' 132' ' ' CYS . 48.5 m -116.58 6.94 13.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.55 31.39 1.33 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.4 mtt85 -111.8 143.69 42.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.827 0.346 . . . . 0.0 110.862 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.5 m-85 -74.87 154.01 38.41 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -76.14 76.05 2.98 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.6 t60 -76.54 149.64 36.65 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -174.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.492 ' H ' ' HG1' ' A' ' 210' ' ' THR . 11.2 tp -98.75 119.09 36.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.966 -1.47 . . . . 0.0 107.614 176.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 44.5 t -113.07 146.74 38.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -105.46 92.67 4.29 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.497 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -76.03 -170.31 29.62 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' ND2' ' H ' ' A' ' 199' ' ' SER . 3.3 p-10 -11.22 -67.57 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.439 0.695 . . . . 0.0 112.812 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.528 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 56.9 m -153.22 12.41 0.48 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 0.0 109.89 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 51.7 m -128.4 -179.8 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.43 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 91.8 m95 -106.5 135.31 48.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 111.245 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.49 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 21.1 m-70 -127.53 173.54 9.78 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.916 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -129.06 128.49 67.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.236 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -144.94 172.09 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.746 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.99 95.98 7.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.39 -179.98 3.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.323 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -88.3 10.21 20.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.903 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -117.87 137.13 52.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.575 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.27 175.7 2.57 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.341 1.067 . . . . 0.0 113.039 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.492 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 32.5 m -168.76 121.65 0.82 Allowed 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.065 -1.88 . . . . 0.0 107.748 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.558 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.6 mt -74.33 130.55 39.9 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.837 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.434 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.2 m95 -118.44 125.32 49.69 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 121.416 0.627 . . . . 0.0 111.343 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.6 m -91.08 101.11 13.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.157 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.67 HG21 ' HG ' ' A' ' 22' ' ' LEU . 98.1 t -93.57 103.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.765 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.82 142.24 28.05 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.218 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.453 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.5 Cg_exo -63.6 104.23 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.218 1.946 . . . . 0.0 111.265 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 216' ' ' PRO . 2.2 mm . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.296 -0.859 . . . . 0.0 111.167 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.575 HE21 ' HA ' ' A' ' 12' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.762 0.315 . . . . 0.0 111.085 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -119.21 154.41 33.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.801 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.28 123.18 27.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.405 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -109.49 157.08 19.34 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.016 0.436 . . . . 0.0 111.296 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.431 ' C ' ' H ' ' A' ' 18' ' ' ASP . 6.1 p -67.79 156.08 37.84 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.66 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.15 -9.18 1.18 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.771 -179.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.5 m-20 -67.88 132.61 47.68 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -79.47 122.28 26.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.5 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.1 m -138.26 171.44 15.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.548 HG13 HD11 ' A' ' 62' ' ' LEU . 3.4 m -132.71 136.49 55.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.163 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.666 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.9 mp -97.16 123.87 41.06 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.556 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.67 HE22 ' HB2' ' A' ' 57' ' ' ASN . 35.0 mt-30 -124.78 145.99 49.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.714 0.769 . . . . 0.0 112.326 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.3 p -132.88 143.64 49.65 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.711 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -86.88 120.23 27.94 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.992 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.404 ' HB1' HD13 ' A' ' 35' ' ' LEU . . . -109.81 119.2 38.62 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.372 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.3 m -123.66 141.73 51.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.345 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.47 HG12 ' ND1' ' A' ' 29' ' ' HIS . 21.2 tt -170.65 140.03 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.86 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.47 ' ND1' HG12 ' A' ' 28' ' ' ILE . 3.6 p-80 38.46 58.4 1.62 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.517 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 6.5 mmmm 58.27 35.61 25.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.965 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -139.0 113.78 9.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -117.95 148.07 42.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.455 ' OE1' HD22 ' A' ' 35' ' ' LEU . 3.6 pt20 -163.01 173.54 13.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.549 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.1 mtpt -118.56 136.84 53.63 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.668 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.98 142.08 51.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.324 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.7 p -105.66 142.12 35.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.072 0.463 . . . . 0.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.466 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -63.71 112.9 3.06 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.047 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.452 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.49 164.07 13.72 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.581 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.9 165.0 14.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.597 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -139.44 146.4 40.04 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.656 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.15 10.84 59.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -121.29 153.58 37.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.743 0.306 . . . . 0.0 110.658 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.7 -135.89 15.07 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.318 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.436 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -87.13 8.21 24.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.658 0.266 . . . . 0.0 110.87 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.14 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.651 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 55.6 mt -80.32 140.44 36.14 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.773 0.32 . . . . 0.0 110.544 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 29.6 p -81.05 150.9 28.64 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 111.112 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -144.4 -166.47 2.39 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.838 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 48.3 mt -130.47 144.93 51.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.335 0.588 . . . . 0.0 112.208 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.9 mt-10 -110.48 135.33 51.32 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.604 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.524 ' HA ' HD23 ' A' ' 35' ' ' LEU . 53.2 m -79.09 132.54 36.63 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.501 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 53.7 p -100.91 170.29 8.4 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.623 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -70.39 -5.98 32.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.427 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 59.91 13.42 3.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.01 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 78.0 p -147.12 80.42 1.52 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 54.4 mtpt -86.22 -28.6 23.76 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 122.937 0.495 . . . . 0.0 110.918 -0.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.67 ' HB2' HE22 ' A' ' 23' ' ' GLN . 2.1 p-10 -176.07 31.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.034 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.46 107.98 1.55 Allowed Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 2.9 Cg_exo -78.48 140.97 17.44 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.905 2.403 . . . . 0.0 111.161 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -48.94 -40.52 40.3 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.477 2.118 . . . . 0.0 111.405 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -128.27 92.99 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.619 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.548 HD11 HG13 ' A' ' 21' ' ' VAL . 48.5 tp -69.8 -30.66 68.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.945 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.6 m -51.83 -46.78 64.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.268 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.452 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.3 pt -70.68 -18.72 21.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 32.5 m -99.9 12.33 37.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.716 0.293 . . . . 0.0 111.073 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -90.14 129.35 36.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 111.841 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -136.17 161.22 36.33 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.148 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.517 HG22 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.27 132.21 71.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.612 178.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.8 mt -80.84 65.81 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.466 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 13.2 mm-40 -44.67 -66.9 0.33 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.427 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -121.25 164.24 17.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.611 0.719 . . . . 0.0 112.895 -177.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -154.76 86.55 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.285 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 mt -113.91 154.47 27.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.387 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.2 t -68.58 146.25 53.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.0 t -45.86 -49.08 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.187 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -52.6 -53.84 41.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.926 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' O ' ' SD ' ' A' ' 81' ' ' MET . . . -57.77 -53.48 57.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.297 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.0 tp -51.49 -45.41 62.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.237 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -65.58 -34.8 79.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.947 0.403 . . . . 0.0 110.284 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.61 -39.05 84.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.715 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.454 ' SD ' ' O ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.33 -47.75 82.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.631 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.16 -34.41 74.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.119 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.23 -31.3 71.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.11 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -73.03 -17.99 61.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 69.8 p -92.98 -3.05 55.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.802 0.334 . . . . 0.0 111.368 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.4 t -75.54 -54.89 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -72.52 96.52 1.95 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.245 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 54.96 -166.04 0.1 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.0 m -95.41 5.43 51.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.942 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -102.39 172.22 7.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.041 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.91 7.77 8.44 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.629 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -94.65 138.17 32.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.797 0.332 . . . . 0.0 110.992 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 13.9 t -77.7 -8.93 12.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.46 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 6.3 m-20 -74.69 81.82 2.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.639 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.94 -4.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.884 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.735 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 12.7 mm-40 -53.95 -42.69 69.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.76 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.735 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 95.3 mttt -86.03 -50.43 7.05 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 120.13 1.332 . . . . 0.0 111.409 -2.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -54.45 -44.14 72.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.057 -177.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.611 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 98.8 mttt -56.07 -34.94 66.43 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.356 -179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.711 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -73.84 -42.48 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.705 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 56.1 tpp -57.33 -41.25 79.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.543 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 54.2 ttp -73.12 -43.03 62.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.554 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.643 ' HZ3' ' HB2' ' A' ' 103' ' ' LYS . 4.9 ttmp? -58.05 -42.59 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.055 0.455 . . . . 0.0 110.307 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.0 m -72.58 -40.43 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.9 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.86 -39.19 84.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.091 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -80.43 -35.68 34.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.587 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.33 -17.61 80.15 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.2 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -71.49 -41.7 57.43 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.426 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -113.15 165.15 12.01 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.469 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -78.4 154.37 30.75 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 117.453 0.626 . . . . 0.0 110.868 0.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.34 140.56 37.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.138 0.494 . . . . 0.0 111.332 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.4 m -72.65 147.45 45.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.196 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.55 129.58 34.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.695 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.489 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -113.03 143.6 44.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.374 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.486 ' HD2' ' HG2' ' A' ' 173' ' ' GLU . 38.0 m-85 -62.66 143.9 56.86 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.115 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 86.07 -14.99 51.41 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.557 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.5 OUTLIER -79.81 141.98 35.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.138 0.494 . . . . 0.0 111.611 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.419 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.54 127.18 33.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.226 177.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.9 pt -112.0 162.62 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.575 0.702 . . . . 0.0 112.855 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.427 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.2 tp -117.36 109.95 17.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.96 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.1 mt -98.02 116.25 29.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.767 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.517 ' NH2' HG22 ' A' ' 68' ' ' VAL . 57.9 ttp85 -102.83 116.8 33.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.787 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.48 ' HD1' ' H ' ' A' ' 126' ' ' SER . 29.9 t-80 -59.39 107.1 0.52 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.6 t -48.66 -50.26 33.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.44 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.5 t80 -61.49 -66.67 0.5 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.48 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 57.9 p -67.41 -21.36 65.59 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.4 -2.01 68.69 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.157 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -83.06 -165.61 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.465 0.174 . . . . 0.0 110.659 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.464 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.3 m-85 -134.03 139.66 46.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.6 tp -55.55 125.31 20.45 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.7 t -133.84 148.23 51.28 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 50.5 t -95.07 98.13 10.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.508 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.67 155.75 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.263 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.8 t -86.43 6.61 29.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.943 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.8 p -92.32 124.21 36.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.655 0.264 . . . . 0.0 111.081 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.1 t -61.51 -58.57 7.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 0.0 110.806 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -152.9 -65.64 0.16 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 80.0 p -132.86 -24.63 1.91 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.95 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.9 p -137.31 -172.49 3.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.3 p -75.73 110.93 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.189 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.4 156.58 40.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.773 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -79.05 -157.3 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.806 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 60.35 -162.9 0.25 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.189 0.519 . . . . 0.0 111.505 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.436 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . -40.84 144.98 0.22 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.503 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.508 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.4 m-85 -104.79 176.07 5.28 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.433 177.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.41 141.75 28.22 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.58 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 59.9 t -111.21 125.87 68.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -141.41 -151.58 5.58 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.562 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 76.8 mt -115.77 143.94 44.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.042 0.448 . . . . 0.0 110.841 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -133.69 141.07 47.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.932 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.14 -64.02 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.54 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.89 149.1 36.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.716 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.1 p -103.46 1.32 32.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.948 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.2 p -55.69 114.46 1.88 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.73 -161.29 18.13 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.606 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.484 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.0 mt-10 -118.2 -11.38 10.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.75 0.31 . . . . 0.0 111.146 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.83 66.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.04 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.4 m -90.21 7.66 37.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.722 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -111.17 132.03 54.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.399 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.9 m95 -127.28 116.42 20.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.676 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 12.8 p -78.85 125.24 29.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.152 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 pt -87.03 137.07 21.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.818 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -130.8 149.21 73.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.264 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.56 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 23.7 Cg_endo -64.36 137.76 57.27 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.323 2.015 . . . . 0.0 112.244 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.1 49.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.742 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 68.6 m -113.15 -167.61 1.21 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 167' ' ' LYS . 8.1 tmtm? -91.41 1.48 57.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.78 -26.53 34.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.56 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 14.6 mmp_? -94.14 145.67 24.53 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.478 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 173' ' ' GLU . 69.4 m -111.63 152.63 27.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.047 -178.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.1 OUTLIER -71.72 132.11 44.07 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 79.77 -4.53 64.87 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 170' ' ' SER . 0.0 OUTLIER -79.16 154.8 29.02 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.66 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.401 ' N ' ' HG3' ' A' ' 173' ' ' GLU . 81.5 mttt -59.05 138.32 57.59 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.225 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 90.1 t -93.75 116.93 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.104 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.422 ' HB2' ' OD2' ' A' ' 179' ' ' ASP . 11.1 mpt_? -80.03 154.01 28.45 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.177 0.513 . . . . 0.0 111.519 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 42.2 t -68.73 122.53 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 176.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.75 -13.5 35.13 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.23 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . 0.448 ' OD2' ' HD2' ' A' ' 169' ' ' ARG . 71.1 m-20 -68.36 129.1 38.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.79 0.329 . . . . 0.0 110.719 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -71.86 112.81 8.28 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 65.2 mt -97.29 150.66 20.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.834 0.826 . . . . 0.0 113.158 -178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 43.9 mt -115.21 113.97 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 176.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.99 135.01 35.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.001 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 191' ' ' TYR . 75.0 t -127.55 122.06 58.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.933 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 29.5 t -62.23 122.03 14.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.484 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -67.08 -30.86 50.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.025 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.49 -40.0 36.64 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.466 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.9 m -115.13 7.78 15.47 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.56 31.63 1.4 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 190' ' ' ARG . 4.9 mtt-85 -113.13 142.26 45.96 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.467 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -73.54 153.33 40.32 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.5 tp -75.12 76.33 2.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 175.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.2 t60 -76.32 151.29 36.73 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.93 115.19 29.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 113.604 -1.634 . . . . 0.0 107.731 177.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 67.7 m -107.86 147.46 30.91 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -106.72 92.26 4.03 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.512 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.47 -173.46 39.75 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.341 -0.933 . . . . 0.0 111.594 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' A' ' 197' ' ' GLY . 10.5 p-10 -5.55 -71.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.444 ' H ' ' CG ' ' A' ' 198' ' ' ASN . 54.3 m -151.97 13.83 0.61 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 31.2 t -127.86 -179.33 4.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.742 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.404 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 94.3 m95 -108.08 134.99 50.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.223 0.535 . . . . 0.0 111.321 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.456 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 20.4 m-70 -127.51 177.96 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.942 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . 0.457 HG12 ' SG ' ' A' ' 47' ' ' CYS . 3.0 p -132.36 130.2 60.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.47 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 54.7 p-10 -146.56 173.97 11.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.632 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.467 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.06 91.76 4.93 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.43 -179.51 3.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -87.73 5.03 41.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.484 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.474 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 65.8 mt-30 -112.99 137.95 50.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.635 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -64.86 175.23 1.56 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 122.35 1.072 . . . . 0.0 112.852 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.8 m -168.17 119.96 0.83 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 112.997 -1.911 . . . . 0.0 107.846 178.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 25.1 mt -74.56 129.34 37.56 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.436 -0.505 . . . . 0.0 109.996 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 99.0 m95 -116.42 145.43 43.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.521 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -112.47 99.86 8.31 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.345 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.666 HG23 ' HG ' ' A' ' 22' ' ' LEU . 86.5 t -91.46 99.98 10.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.573 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.63 140.47 23.92 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.429 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.3 Cg_exo -62.36 103.97 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.097 1.865 . . . . 0.0 111.141 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.5 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.6 mm . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.295 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG2' ' HB ' ' A' ' 177' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.867 0.365 . . . . 0.0 111.037 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -114.42 160.92 18.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.215 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.8 mt -82.85 118.74 23.64 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.6 mmm180 -107.36 158.13 17.4 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.242 0.544 . . . . 0.0 111.342 -179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.505 ' OG1' ' HB3' ' A' ' 110' ' ' HIS . 3.9 p -68.41 154.44 41.81 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 72.46 -2.91 2.47 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.786 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.1 m-20 -73.82 138.44 44.45 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.741 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -84.34 121.18 27.17 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.486 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.7 m -137.5 169.73 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.527 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.7 137.04 56.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 114.678 -1.147 . . . . 0.0 108.277 176.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.709 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.3 mp -97.8 123.91 41.96 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.614 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.449 ' OE1' ' HB3' ' A' ' 57' ' ' ASN . 23.4 mt-30 -124.56 146.75 48.85 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.544 0.688 . . . . 0.0 112.194 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.23 143.67 49.28 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.746 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 m -86.56 120.48 27.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.213 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.423 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -111.74 121.09 44.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.179 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.8 m -125.75 133.13 52.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.004 0.43 . . . . 0.0 111.775 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.9 tt -169.85 146.56 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.382 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 57.68 43.7 21.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.02 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 58.91 23.57 11.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.364 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.03 144.12 50.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.371 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -132.0 147.6 52.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.917 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -161.35 171.13 18.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.548 ' H ' HD22 ' A' ' 54' ' ' ASN . 21.6 mtpp -118.85 139.12 52.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.381 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.5 mt -127.9 144.24 51.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.303 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.6 p -108.37 139.83 42.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 0.0 110.693 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.472 ' HA ' HD22 ' A' ' 49' ' ' LEU . 32.1 tp -62.13 113.23 2.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.1 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.428 ' HB2' HD13 ' A' ' 64' ' ' ILE . . . -114.37 168.3 9.97 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.597 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -172.74 165.34 5.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.66 150.97 48.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.511 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.26 -0.35 88.58 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.816 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -113.96 153.87 28.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.868 0.366 . . . . 0.0 111.056 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.38 -128.24 8.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.523 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.494 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.0 t-20 -91.31 3.87 53.78 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.749 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 43.12 28.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.584 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 mt -81.31 133.87 35.5 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.418 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.445 ' HG ' ' HA2' ' A' ' 148' ' ' GLY . 76.7 m -72.63 150.2 43.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.551 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -145.94 -170.39 3.47 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.503 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 37' ' ' LEU . 24.1 mt -129.17 143.28 50.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.497 0.665 . . . . 0.0 112.45 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.4 mt-10 -107.68 138.44 43.9 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.765 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.461 ' HA ' HD21 ' A' ' 35' ' ' LEU . 53.0 m -81.99 133.13 35.28 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 176.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.524 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 49.3 p -103.29 165.13 11.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.686 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 88.5 p -72.49 -7.86 52.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.181 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.548 HD22 ' H ' ' A' ' 34' ' ' LYS . 15.6 m120 60.74 12.59 3.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.974 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.409 ' N ' ' H ' ' A' ' 57' ' ' ASN . 71.0 p -156.2 79.47 0.97 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -107.13 91.22 3.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.15 0.58 . . . . 0.0 110.929 -0.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' C ' ' HB ' ' A' ' 52' ' ' THR . 6.5 m120 56.32 20.59 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.06 108.63 1.99 Allowed Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 2.9 Cg_exo -78.54 139.6 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.907 2.405 . . . . 0.0 111.157 177.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -49.08 -39.1 41.25 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.358 2.039 . . . . 0.0 111.542 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -128.42 89.71 2.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.674 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.527 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp -66.95 -29.24 69.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.168 -178.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.0 m -52.28 -50.22 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.428 HD13 ' HB2' ' A' ' 38' ' ' ALA . 29.8 pt -68.6 -17.34 22.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 51.4 m -100.27 11.4 39.47 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.826 0.346 . . . . 0.0 111.03 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -90.22 130.11 36.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.11 0.481 . . . . 0.0 111.689 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -136.45 160.83 37.58 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.102 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.3 t -124.83 132.57 71.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.863 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.408 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.6 mt -80.9 64.33 5.62 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.6 mm-40 -43.5 -64.02 0.73 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.414 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.5 mm100 -123.18 162.93 21.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.707 0.765 . . . . 0.0 112.888 -177.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.6 m -154.13 84.9 1.14 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.987 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 mt -113.18 154.19 27.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.187 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.516 ' HB3' HH12 ' A' ' 76' ' ' ARG . 47.4 t -67.76 149.1 50.37 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 48.5 t -49.94 -43.86 20.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.88 0.371 . . . . 0.0 110.276 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.516 HH12 ' HB3' ' A' ' 74' ' ' SER . 1.9 tmm_? -58.7 -52.94 63.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.22 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -59.51 -44.11 93.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.702 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.9 tp -62.24 -48.06 81.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.345 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.74 -32.27 73.72 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.816 0.341 . . . . 0.0 110.543 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.2 -41.2 86.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.654 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.5 mtt -64.11 -45.33 89.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.912 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 64.0 mt -68.27 -35.47 77.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.0 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.37 75.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -67.32 -29.79 69.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.352 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.9 p -76.12 -16.18 59.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.277 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.5 t -84.52 -27.87 6.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.092 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.502 ' HG3' ' HG2' ' A' ' 88' ' ' LYS . 14.1 tp10 -85.46 -79.07 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.502 ' HG2' ' HG3' ' A' ' 87' ' ' GLU . 7.6 ptpp? -170.08 -176.79 2.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.011 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t 63.27 159.49 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.434 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -169.09 172.73 7.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.748 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 110.38 28.29 4.12 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.638 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 60.16 -179.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.884 0.374 . . . . 0.0 111.054 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 m -87.77 146.99 5.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.003 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.621 ' HA ' ' HD3' ' A' ' 97' ' ' LYS . 16.8 m-20 -121.73 77.54 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.888 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.3 t -71.02 -59.37 3.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.642 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 10.8 mm-40 -73.31 -51.77 16.31 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.027 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.642 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 25.1 tptp -87.75 -38.2 15.98 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 124.5 1.12 . . . . 0.0 109.942 -4.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -53.62 -44.64 69.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.697 -178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.565 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -61.69 -27.7 68.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.211 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.606 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 66.4 t80 -74.25 -49.44 23.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.501 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 97' ' ' LYS . 58.6 ttp -60.66 -38.84 86.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.846 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.1 mtp -72.13 -45.4 60.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.014 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -59.15 -41.07 87.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.837 0.351 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 55.2 p -71.91 -43.81 64.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.91 -29.59 70.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.33 -56.43 4.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.797 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.37 -28.57 67.38 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.77 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 113.81 -115.5 3.61 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.433 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' A' ' 110' ' ' HIS . . . -171.55 146.08 9.23 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.546 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.505 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 37.6 t-80 -152.09 -59.19 0.15 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.915 0.858 . . . . 0.0 110.83 -0.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.439 ' HG2' ' HD1' ' A' ' 110' ' ' HIS . 13.4 ptp180 -162.91 145.89 10.76 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-O 121.373 0.606 . . . . 0.0 112.16 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.4 m -81.49 150.55 28.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.838 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.42 130.44 35.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.734 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.5 mt -115.49 143.25 45.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.142 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.562 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.4 m-85 -63.97 129.68 41.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.039 0.447 . . . . 0.0 110.49 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.43 -11.71 58.25 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.944 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.01 141.09 31.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.091 0.472 . . . . 0.0 111.388 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.02 127.18 33.33 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 160' ' ' TRP . 40.5 pt -110.99 163.52 7.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.541 0.686 . . . . 0.0 112.602 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.414 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.5 tp -118.81 108.46 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.752 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.7 mt -96.75 117.47 31.11 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.739 -178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.485 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 18.9 ttp180 -104.02 116.69 32.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.553 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.491 ' HD1' ' H ' ' A' ' 126' ' ' SER . 26.8 t-80 -59.82 106.68 0.51 Allowed 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.7 t -49.83 -45.31 50.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.428 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 31.8 t80 -67.01 -59.88 3.11 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.491 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 12.9 m -74.72 -14.74 60.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.26 -2.84 26.05 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.376 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.405 ' HB2' ' HB3' ' A' ' 149' ' ' LEU . 50.1 mtt -82.95 -165.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.438 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.4 m-85 -132.94 138.9 47.07 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.2 tp -54.78 126.03 22.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.491 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 16.7 p -136.34 148.66 48.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.3 t -94.82 97.4 10.01 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.726 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -72.89 154.86 40.4 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.458 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -83.0 2.31 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.186 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.5 p -95.74 120.97 36.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.78 0.324 . . . . 0.0 111.107 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 78.0 p -67.05 -52.17 45.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.551 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.442 ' N ' ' HG ' ' A' ' 136' ' ' SER . 15.8 ptm180 -174.74 -28.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.0 p -163.37 65.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.653 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 56.2 m 64.25 154.93 0.06 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.282 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 53.4 m 65.7 129.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.481 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.85 130.62 47.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.706 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -142.96 94.14 2.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.493 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.409 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 4.4 mm? 56.27 -84.62 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.321 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -101.93 154.27 19.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.482 0.658 . . . . 0.0 112.085 -178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.495 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.2 m-85 -100.54 170.24 8.51 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.113 177.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -89.38 145.1 25.57 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.7 t -113.89 117.14 54.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.529 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . 0.445 ' HA2' ' HG ' ' A' ' 47' ' ' CYS . . . -134.23 -151.54 6.45 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.987 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.9 mt -115.71 141.72 47.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.423 . . . . 0.0 110.731 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.491 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -130.92 140.72 50.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.695 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.86 -69.01 0.37 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.585 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.96 148.41 46.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.685 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.0 p -104.21 0.16 29.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.127 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -55.54 112.77 1.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.436 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.17 -160.22 20.57 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.672 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 32.0 mt-10 -118.95 -10.73 9.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.98 -33.13 66.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 82.5 m -91.84 9.69 31.74 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.18 132.5 54.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 0.0 111.353 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.437 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -128.44 116.66 20.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.728 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 15.5 p -78.6 126.73 31.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.252 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.9 pt -88.93 136.77 22.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.879 0.371 . . . . 0.0 110.887 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -130.77 150.3 76.06 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.315 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.661 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 39.5 Cg_endo -66.49 141.01 59.52 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.664 2.242 . . . . 0.0 112.295 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.52 -46.31 48.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.78 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 21.3 t -113.61 -177.23 3.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.126 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.486 ' HD2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -85.31 15.23 4.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.281 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.486 HE22 ' HD2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -85.89 -36.25 20.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.196 0.522 . . . . 0.0 110.2 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.661 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.8 mmp_? -93.89 148.23 22.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.061 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 49.1 m -125.12 166.71 15.93 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.234 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.47 133.44 50.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.186 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 90.83 -12.07 69.95 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.302 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.8 mt-10 -72.42 154.6 40.8 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 120.999 0.428 . . . . 0.0 111.183 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -70.42 142.44 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.404 HG11 HD21 ' A' ' 181' ' ' LEU . 85.8 t -92.48 111.88 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.588 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 155.29 38.09 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 121.435 0.636 . . . . 0.0 111.49 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . 0.436 ' HB ' ' HG2' ' A' ' 12' ' ' GLN . 41.5 t -71.37 120.41 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.2 -12.37 33.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.261 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.778 0.323 . . . . 0.0 110.859 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.1 m-20 -69.93 110.65 5.14 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 175' ' ' VAL . 70.2 mt -97.28 148.89 22.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.783 0.801 . . . . 0.0 113.088 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.503 HD13 ' NE2' ' A' ' 209' ' ' GLN . 52.6 mt -114.16 113.18 43.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.5 mp -93.34 137.51 32.58 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.0 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.5 t -129.19 126.85 64.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.61 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.541 ' HG ' ' H ' ' A' ' 188' ' ' SER . 41.2 t -66.09 127.72 33.25 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 99.5 t -71.22 -32.12 46.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.979 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -80.13 -35.69 36.34 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.541 ' H ' ' HG ' ' A' ' 185' ' ' SER . 53.5 m -116.94 4.79 12.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.42 31.8 1.39 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.409 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 26.1 mtt180 -113.58 141.05 47.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.019 0.437 . . . . 0.0 110.759 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 48.5 m-85 -71.5 153.71 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.41 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.23 75.61 2.36 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.08 150.36 38.88 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -174.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.3 tp -100.28 116.53 32.47 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 113.667 -1.606 . . . . 0.0 107.632 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.5 t -110.16 146.79 34.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -105.26 94.56 5.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.497 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.86 -169.51 33.81 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.961 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.9 p30 -11.54 -66.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.425 0.69 . . . . 0.0 112.714 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 53.1 m -154.62 11.92 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.193 0.52 . . . . 0.0 109.731 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 69.4 m -127.04 -178.69 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.851 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.423 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 93.3 m95 -107.64 135.69 48.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.167 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.491 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 16.9 m-70 -128.32 172.99 10.55 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.004 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.9 p -127.2 134.32 66.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.297 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.406 ' OD1' ' HB3' ' A' ' 206' ' ' ALA . 2.9 p30 -151.7 172.03 16.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.594 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.468 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.86 93.84 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.209 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.406 ' HB3' ' OD1' ' A' ' 204' ' ' ASP . . . -113.04 174.09 6.07 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.191 -177.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -83.08 9.35 10.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.01 135.54 54.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.678 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.503 ' NE2' HD13 ' A' ' 182' ' ' ILE . 92.4 mt-30 -65.61 175.56 1.8 Allowed 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.284 1.04 . . . . 0.0 113.028 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.9 m -168.73 122.32 0.85 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.144 -1.844 . . . . 0.0 107.936 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 55.1 mt -76.42 127.43 32.83 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.082 0.468 . . . . 0.0 109.969 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.412 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.4 m95 -114.81 146.98 40.43 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.682 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.9 t -114.15 100.8 8.65 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.163 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.709 HG21 ' HG ' ' A' ' 22' ' ' LEU . 78.4 t -92.6 102.02 13.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.74 141.04 25.43 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.113 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.428 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.86 103.41 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.129 1.886 . . . . 0.0 111.266 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.486 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.461 ' HG2' ' HB ' ' A' ' 177' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.879 0.371 . . . . 0.0 110.978 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -115.52 157.47 24.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.388 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -80.18 122.63 27.07 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 11.2 mmm180 -111.63 157.84 19.95 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.059 0.457 . . . . 0.0 111.215 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.431 ' C ' ' H ' ' A' ' 18' ' ' ASP . 11.6 p -68.36 155.32 40.04 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.868 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.94 -8.37 1.29 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.639 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.439 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.7 m-20 -69.07 135.03 50.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.24 119.03 22.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.47 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.1 m -135.08 171.9 16.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.664 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.05 140.89 45.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.658 -1.156 . . . . 0.0 108.473 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.667 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.7 mp -101.52 121.1 41.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.689 0.281 . . . . 0.0 110.5 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -121.58 152.59 39.08 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.536 0.684 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.449 ' SG ' HD21 ' A' ' 194' ' ' LEU . 24.3 t -139.05 143.99 38.61 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.741 179.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.3 m -86.33 121.28 28.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.39 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.408 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -113.16 119.92 39.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.001 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.6 m -124.86 137.04 54.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.944 0.402 . . . . 0.0 111.582 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.7 tt -173.08 143.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.54 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.8 m80 58.91 37.41 24.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.877 0.37 . . . . 0.0 110.713 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.88 25.63 15.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.105 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -127.07 122.59 34.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.468 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -114.98 145.18 42.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.332 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.465 ' OE1' HD22 ' A' ' 35' ' ' LEU . 3.8 pt20 -157.63 171.15 20.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.563 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.48 ' HZ3' ' HB3' ' A' ' 57' ' ' ASN . 40.2 mtmt -118.56 134.83 54.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.59 178.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.465 HD22 ' OE1' ' A' ' 33' ' ' GLN . 1.6 mt -124.47 142.47 51.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.341 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 54.0 t -107.09 141.3 38.54 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.644 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 tp -61.01 113.22 2.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.992 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.445 ' HB2' HD13 ' A' ' 64' ' ' ILE . . . -112.15 164.74 12.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.271 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.35 162.32 10.32 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.694 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -133.18 146.7 51.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.831 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.89 3.34 85.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.788 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -114.08 152.18 31.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 110.972 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.02 -140.45 23.13 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.725 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -78.0 4.69 11.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.621 0.248 . . . . 0.0 111.147 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.25 31.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.158 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.3 mt -77.67 139.72 39.48 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.466 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.0 m -79.58 149.7 31.3 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.564 0.697 . . . . 0.0 111.284 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -145.18 -166.21 2.37 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.555 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.6 mt -130.47 145.21 51.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.438 0.637 . . . . 0.0 112.301 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -111.17 135.19 52.05 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.769 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.458 ' HA ' HD23 ' A' ' 35' ' ' LEU . 80.1 p -77.58 138.13 38.97 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.62 ' O ' ' N ' ' A' ' 54' ' ' ASN . 69.8 p -103.42 129.92 50.64 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.109 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.51 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 p -10.91 63.79 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 52' ' ' THR . 24.0 t-20 66.97 -9.45 0.36 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.644 ' HA ' ' C ' ' A' ' 56' ' ' LYS . 88.3 p 54.58 101.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.808 0.443 . . . . 0.0 112.009 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.644 ' C ' ' HA ' ' A' ' 55' ' ' SER . 0.1 OUTLIER 55.6 -142.2 0.8 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.921 1.288 . . . . 0.0 111.844 -0.077 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 34' ' ' LYS . 8.8 p30 -178.12 -19.97 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.898 0.38 . . . . 0.0 110.875 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.494 ' HB ' ' HG ' ' A' ' 53' ' ' SER . 21.8 t -63.67 108.91 2.07 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 3.9 Cg_exo -78.0 139.95 17.67 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 176.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -51.77 -38.93 68.01 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.331 2.02 . . . . 0.0 111.531 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -126.52 91.07 3.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.74 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.578 HD13 HG13 ' A' ' 21' ' ' VAL . 47.3 tp -69.33 -31.14 69.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.662 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -49.6 -48.14 49.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.445 HD13 ' HB2' ' A' ' 38' ' ' ALA . 29.6 pt -72.67 -17.88 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 111.467 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.664 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.69 -0.67 45.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.118 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.3 m -86.2 132.77 33.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.208 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -137.4 163.08 31.92 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.889 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.491 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.6 t -126.14 133.6 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.719 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 HG13 ' A' ' 20' ' ' VAL . 15.9 mt -82.58 64.35 7.18 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.484 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 9.1 mm-40 -43.7 -61.32 1.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -178.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -125.36 164.53 20.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 112.893 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.533 ' HG ' HG21 ' A' ' 119' ' ' ILE . 49.2 m -156.64 85.08 0.97 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.893 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mt -114.9 155.44 26.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.279 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.502 ' HG ' ' H ' ' A' ' 77' ' ' ALA . 80.3 p -68.6 148.52 50.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.2 t -50.03 -44.16 21.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.161 0.505 . . . . 0.0 110.235 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.0 ttp85 -57.91 -51.2 70.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.236 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.502 ' H ' ' HG ' ' A' ' 74' ' ' SER . . . -62.84 -43.06 99.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.706 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.83 -47.11 87.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.988 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -65.33 -35.26 80.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.97 -43.22 93.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.653 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -62.41 -44.52 96.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.85 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.65 -31.81 70.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.99 -31.77 68.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.724 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -67.97 -22.32 65.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.168 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 45.4 p -84.74 -13.54 50.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.167 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.27 -43.29 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.022 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -150.72 105.61 3.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.639 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -74.58 157.02 36.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.986 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 52.6 m -124.97 -63.19 1.18 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.792 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -89.16 -71.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.31 34.25 3.7 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.81 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -152.58 132.16 13.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.847 0.356 . . . . 0.0 110.794 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.3 t -96.55 -66.43 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.316 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -71.84 89.59 1.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.77 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.0 t -87.16 -9.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.868 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.754 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 8.2 mm-40 -53.96 -40.58 66.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.882 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.754 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 18.9 pttp -86.53 -50.53 6.78 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 120.349 1.431 . . . . 0.0 111.611 -2.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.485 ' H ' ' HG3' ' A' ' 97' ' ' LYS . 65.6 t-105 -56.55 -39.24 73.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.293 -1.321 . . . . 0.0 113.135 -177.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.479 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 51.6 tttp -61.39 -33.75 74.19 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.287 -179.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.749 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 24.5 t80 -73.93 -44.8 53.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.899 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 17.6 tpt -59.37 -39.17 82.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.65 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 53.1 ttp -71.0 -47.37 59.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.849 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -59.06 -45.01 91.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.1 m -66.98 -46.96 73.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.108 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.88 72.15 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.189 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -64.67 -36.43 84.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.753 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.92 -76.76 0.62 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.452 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 53.86 -123.12 25.65 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.577 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -127.08 -172.27 13.23 Favored Glycine 0 CA--C 1.52 0.393 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.256 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -83.99 -167.69 1.84 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 117.648 0.724 . . . . 0.0 111.215 0.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -148.11 152.39 37.24 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.161 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.437 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 91.2 m -79.33 145.34 33.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.33 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.54 132.25 35.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.802 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -116.31 142.46 46.81 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.202 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.53 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.3 m-85 -62.56 129.82 42.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.083 0.468 . . . . 0.0 110.473 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.56 -12.21 58.14 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.56 140.42 32.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.971 0.415 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.98 128.31 33.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.533 HG21 ' HG ' ' A' ' 72' ' ' SER . 43.0 pt -112.42 158.62 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 112.747 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.1 tp -114.44 108.98 17.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.88 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.0 mt -97.35 115.6 28.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.691 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.491 ' NH2' HG21 ' A' ' 68' ' ' VAL . 64.9 ttp85 -102.22 116.42 32.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.712 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.452 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.6 t-80 -58.09 108.69 0.63 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 67.6 m -50.3 -53.3 29.58 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.452 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.8 t80 -56.82 -69.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.425 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 54.8 p -63.96 -31.96 73.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 89.24 -0.54 81.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.959 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.9 mtt -83.73 -165.82 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.432 -0.21 . . . . 0.0 110.432 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.484 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.3 m-85 -133.66 138.38 45.86 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.8 tp -54.07 125.96 20.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.465 ' HG ' ' HB2' ' A' ' 157' ' ' ALA . 47.6 t -135.13 149.93 50.1 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 40.8 t -96.69 97.12 9.1 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.476 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.7 mt -74.0 155.93 38.08 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.483 -178.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.3 m -84.93 2.37 43.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.856 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 48.0 p -89.16 124.55 34.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.692 0.282 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.6 p -66.08 -60.54 2.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.4 -78.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.468 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 72.8 m -161.58 8.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.718 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 11.5 t -123.94 -169.16 1.91 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.891 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 10.2 m -88.81 -9.38 51.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.451 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -51.18 153.01 2.13 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -130.71 10.9 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.589 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.66 -83.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -98.19 152.14 19.69 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 121.414 0.626 . . . . 0.0 111.997 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.476 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.3 m-85 -101.9 174.28 6.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.93 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -93.65 142.55 27.22 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.54 118.68 58.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.97 5.91 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.713 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 54.3 mt -115.07 146.73 41.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.074 0.464 . . . . 0.0 110.67 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -138.72 139.72 38.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.848 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.81 -78.56 0.07 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.692 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.21 146.91 46.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.645 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 74.1 p -105.13 5.42 32.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.267 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.9 p -58.35 111.69 1.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.668 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.53 -163.35 19.53 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.937 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 30.8 mt-10 -116.35 -8.81 11.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.774 0.321 . . . . 0.0 111.261 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.465 ' HB2' ' HG ' ' A' ' 131' ' ' CYS . . . -57.84 -32.13 67.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.5 p -93.41 10.27 32.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.11 131.71 54.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.1 0.476 . . . . 0.0 111.479 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.413 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.6 m95 -126.63 116.76 21.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.912 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.9 p -78.62 127.09 31.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.167 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.9 pt -88.86 135.02 26.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.947 0.403 . . . . 0.0 110.953 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.5 m80 -127.26 149.88 70.9 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.217 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.58 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.41 138.07 49.23 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.522 2.148 . . . . 0.0 112.216 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.21 -40.3 52.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.565 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.2 p -108.63 -171.75 1.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.489 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -91.78 -8.0 47.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.203 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -71.42 -34.25 70.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.211 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 71.3 mmt-85 -89.99 146.3 24.47 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.708 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 40.8 t -129.19 168.18 16.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.976 0.417 . . . . 0.0 111.383 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.7 136.16 55.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.96 -17.3 51.85 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.293 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 170' ' ' SER . 24.1 mt-10 -67.3 155.99 37.52 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.919 0.39 . . . . 0.0 111.396 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.4 mttt -71.84 144.17 49.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.477 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 92.8 t -94.89 112.81 28.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.316 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -77.7 155.17 31.46 Favored 'General case' 0 CA--C 1.5 -0.964 0 CA-C-O 121.392 0.615 . . . . 0.0 111.471 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . 0.461 ' HB ' ' HG2' ' A' ' 12' ' ' GLN . 53.0 t -69.2 121.82 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.72 -17.15 33.33 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.291 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -63.27 127.02 29.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.738 0.304 . . . . 0.0 110.824 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.408 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.6 m-20 -69.88 112.89 6.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.476 HD12 HG21 ' A' ' 214' ' ' VAL . 60.0 mt -98.19 149.01 23.01 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 48.6 mt -113.56 113.23 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.5 136.17 33.44 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.257 0.551 . . . . 0.0 112.354 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.406 HG23 ' CD1' ' A' ' 191' ' ' TYR . 70.8 t -129.03 125.25 62.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.545 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 45.4 t -64.5 126.55 28.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.77 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -69.77 -33.93 58.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.991 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.36 -36.32 39.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 56.3 m -116.3 5.45 13.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.07 31.26 1.53 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 31.4 mtt85 -112.04 142.67 44.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.899 0.38 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.9 m-85 -74.29 153.56 39.31 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -75.86 76.82 2.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 175.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -76.44 149.32 36.86 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 -174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.449 HD21 ' SG ' ' A' ' 24' ' ' CYS . 11.4 tp -100.33 114.64 28.3 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.634 177.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 41.6 t -107.17 147.33 30.23 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -106.45 91.39 3.68 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.532 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -76.14 -174.19 37.13 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.496 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 80.3 m-20 -5.6 -75.87 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.243 0.617 . . . . 0.0 112.457 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 35.8 t -146.32 14.4 1.27 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.097 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 59.3 m -128.33 -179.83 5.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.996 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.408 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.4 m95 -107.89 135.48 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.23 0.538 . . . . 0.0 111.243 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.481 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 17.3 m-70 -128.2 174.92 8.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.881 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.7 p -129.29 133.16 66.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.35 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.77 173.07 14.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.669 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.37 96.24 7.58 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.401 ' HB2' ' OD1' ' A' ' 204' ' ' ASP . . . -115.71 -179.5 3.67 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -88.44 10.72 19.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.424 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -118.99 134.88 54.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.058 0.456 . . . . 0.0 110.72 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.31 175.09 0.6 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.364 1.078 . . . . 0.0 112.844 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.412 HG22 ' SG ' ' A' ' 24' ' ' CYS . 22.8 m -168.65 119.35 0.76 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 112.979 -1.918 . . . . 0.0 107.782 178.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.7 mt -74.19 128.89 36.71 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.024 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.4 m95 -116.12 146.31 42.34 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.466 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -113.78 100.55 8.54 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.304 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.667 HG23 ' HG ' ' A' ' 22' ' ' LEU . 95.6 t -92.88 100.55 11.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.19 141.8 26.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.074 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 217' ' ' ILE . 26.8 Cg_exo -62.42 103.88 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.192 1.928 . . . . 0.0 111.265 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.47 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.311 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -120.2 150.36 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.43 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.92 129.58 38.18 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -117.4 157.38 26.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.098 0.475 . . . . 0.0 111.103 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.418 ' C ' ' H ' ' A' ' 18' ' ' ASP . 9.1 p -67.95 155.08 40.25 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.726 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.07 -7.8 1.43 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.699 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.418 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.9 m-20 -69.33 133.05 47.37 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.836 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.32 121.16 25.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.434 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 22.1 m -136.07 173.0 14.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.564 HG12 HD11 ' A' ' 62' ' ' LEU . 3.1 m -134.93 136.74 51.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.169 176.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.4 mp -98.06 124.86 42.77 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.655 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.589 HE22 ' HB2' ' A' ' 57' ' ' ASN . 71.9 mt-30 -124.91 145.01 50.03 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 121.664 0.745 . . . . 0.0 112.295 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.7 p -131.42 146.11 52.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.882 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -88.16 123.49 32.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.443 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -115.37 120.03 38.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.304 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.8 m -125.17 136.51 53.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.934 0.397 . . . . 0.0 111.685 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.0 tt -173.8 143.64 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.564 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 49.0 m80 61.15 32.63 19.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.734 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mmmm 67.74 22.31 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.075 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -126.06 124.61 41.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.511 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.16 147.28 41.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.208 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -158.21 172.98 17.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -120.4 136.02 54.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 51' ' ' SER . 1.1 mt -125.3 145.28 50.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.391 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 28.9 p -107.42 140.09 40.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.08 0.467 . . . . 0.0 110.622 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.483 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -62.75 111.62 2.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.072 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB3' HD11 ' A' ' 64' ' ' ILE . . . -110.69 166.05 11.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.461 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.2 163.09 15.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.31 149.94 46.14 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.66 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.1 -5.25 89.32 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.755 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -107.39 157.35 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 0.0 110.938 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -141.57 23.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.368 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -83.34 9.54 10.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.683 0.278 . . . . 0.0 110.705 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.28 29.78 0.25 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.124 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -80.01 139.41 36.99 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.819 0.342 . . . . 0.0 110.512 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.582 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 31.5 p -78.71 148.15 33.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.364 0.602 . . . . 0.0 111.031 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -141.25 -165.57 1.99 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.001 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 29.7 mt -131.97 146.22 51.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.293 0.568 . . . . 0.0 112.374 -178.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.495 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 3.8 mt-10 -111.6 134.57 53.09 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.718 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.503 ' HA ' HD21 ' A' ' 35' ' ' LEU . 81.4 p -77.75 130.39 36.68 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 70.5 p -103.09 170.4 7.99 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.3 m -72.8 11.48 0.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.44 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 52' ' ' THR . 25.0 t-20 66.31 -78.93 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.453 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 46.8 t -129.67 98.92 4.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.81 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.497 ' HB3' HG23 ' A' ' 58' ' ' VAL . 62.2 tttm -72.33 163.11 28.52 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.127 0.571 . . . . 0.0 110.842 0.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.589 ' HB2' HE22 ' A' ' 23' ' ' GLN . 23.3 p30 -81.44 42.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 56' ' ' LYS . 61.9 t -64.21 111.72 6.09 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -78.74 140.17 16.28 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.831 2.354 . . . . 0.0 110.906 176.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -48.65 -38.99 37.67 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.338 2.025 . . . . 0.0 111.619 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -134.02 97.19 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.562 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.564 HD11 HG12 ' A' ' 21' ' ' VAL . 49.2 tp -71.75 -30.39 65.54 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.141 -178.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.4 m -50.94 -44.31 60.37 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.455 HD11 ' HB3' ' A' ' 38' ' ' ALA . 23.3 pt -73.07 -20.67 18.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 56.4 m -97.54 12.75 32.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.948 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.6 m -91.31 128.29 37.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.145 0.498 . . . . 0.0 111.729 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -136.09 161.53 35.45 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.129 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.514 HG23 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -125.46 132.43 71.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.5 mt -80.71 66.56 6.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 16.3 mm-40 -45.68 -64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -122.12 163.08 20.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.705 0.764 . . . . 0.0 112.826 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.3 m -154.69 85.9 1.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.427 -1.26 . . . . 0.0 108.771 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.9 158.09 20.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.538 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.9 p -70.49 146.49 50.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.446 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 50.7 t -48.63 -44.25 14.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.099 0.476 . . . . 0.0 110.539 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -57.98 -53.11 61.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.3 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.27 -43.3 96.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.769 -179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.4 tp -62.03 -47.54 84.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.306 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 51.9 mt-30 -64.36 -35.99 82.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.728 0.299 . . . . 0.0 110.741 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -65.08 -43.38 92.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.868 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.401 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.8 mtt -61.95 -43.42 98.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.693 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -69.86 -32.97 71.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.845 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.91 -31.42 69.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.788 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -76.29 -18.06 59.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.537 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 70.8 p -88.65 -7.51 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.845 0.355 . . . . 0.0 111.182 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.5 t -79.84 -31.78 13.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.717 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -94.36 -60.33 1.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.748 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -113.06 128.26 56.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.917 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.0 m -61.96 -73.01 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.944 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -132.13 -80.2 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.988 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.29 20.01 68.97 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.461 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -117.73 150.83 38.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.857 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -136.56 137.0 48.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.958 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.517 ' HB3' ' HG2' ' A' ' 96' ' ' GLU . 5.8 m-20 -73.96 93.78 2.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.078 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.63 2.52 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 121.246 0.546 . . . . 0.0 110.84 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.697 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.5 OUTLIER -52.41 -50.14 63.1 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.715 -179.298 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.697 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 84.9 mttt -89.84 -56.02 3.4 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-O 123.229 1.49 . . . . 0.0 108.547 -5.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.434 ' HA ' ' HB3' ' A' ' 101' ' ' MET . 76.4 m95 -77.06 -27.44 54.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 112.661 -2.063 . . . . 0.0 111.66 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -56.05 -58.76 6.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.895 -178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.576 ' HB3' ' HG3' ' A' ' 96' ' ' GLU . 2.5 t80 -77.26 -33.46 55.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.838 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.434 ' HB3' ' HA ' ' A' ' 98' ' ' TRP . 1.8 tmt? -56.31 -49.52 74.07 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.395 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.8 mtm -74.66 -43.41 55.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -57.15 -43.63 82.67 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.829 0.347 . . . . 0.0 110.963 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.9 m -72.58 -46.78 52.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.31 -34.46 66.54 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.366 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -89.04 -30.41 18.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.003 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.04 -62.53 4.4 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.575 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 79.82 -76.61 1.99 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.415 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.43 -172.13 14.26 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.352 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -151.46 160.92 43.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.547 0.674 . . . . 0.0 110.335 -0.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 20.1 ptp180 -168.12 152.24 6.18 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.036 0.445 . . . . 0.0 111.336 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.418 HG23 ' HG2' ' A' ' 174' ' ' LYS . 86.2 m -79.93 145.27 32.73 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.105 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.29 131.19 35.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.659 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -115.34 142.7 46.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.199 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.58 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.9 m-85 -62.81 134.44 56.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.053 0.454 . . . . 0.0 110.5 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.06 -14.4 63.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.986 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.439 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -81.53 141.1 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.085 0.469 . . . . 0.0 111.361 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.72 128.41 34.34 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.156 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -113.11 160.43 12.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.638 0.732 . . . . 0.0 112.73 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 22.2 tp -116.52 108.82 16.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.94 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 52.3 mt -96.62 116.45 29.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.675 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.514 ' NH2' HG23 ' A' ' 68' ' ' VAL . 55.1 ttp85 -102.49 116.95 33.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.749 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.444 ' HD1' ' H ' ' A' ' 126' ' ' SER . 29.5 t-80 -59.2 107.6 0.57 Allowed 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 177.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 35.1 t -48.47 -54.78 12.95 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.426 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.1 t80 -56.82 -70.05 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.53 ' HG ' ' H ' ' A' ' 128' ' ' MET . 54.6 p -63.18 -28.81 70.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 86.83 -5.44 84.98 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.92 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.53 ' H ' ' HG ' ' A' ' 126' ' ' SER . 48.0 mtt -80.18 -165.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.446 0.165 . . . . 0.0 110.703 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.451 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.3 m-85 -134.02 140.21 46.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.36 126.25 24.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.0 t -135.18 148.28 49.64 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.1 t -94.83 97.92 10.38 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.511 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.32 147.37 40.21 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.0 t -78.34 2.35 18.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.587 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 40.5 p -87.97 121.67 30.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 141' ' ' ASP . 47.2 t -62.41 -60.41 3.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.578 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -172.42 70.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 88.1 p 48.02 31.16 2.31 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.218 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.0 p -162.88 -162.64 0.79 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.044 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 33.7 m -53.97 148.42 10.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.329 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.431 ' HA ' ' HB2' ' A' ' 136' ' ' SER . 2.8 p-10 -60.24 147.66 39.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.541 ' HG2' ' H ' ' A' ' 143' ' ' LEU . 11.7 ttmm -147.36 -157.56 0.82 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.83 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.541 ' H ' ' HG2' ' A' ' 142' ' ' LYS . 3.8 mm? -57.67 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.042 0.449 . . . . 0.0 111.524 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -84.19 151.68 24.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.835 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.511 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -102.69 174.26 5.97 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.963 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -93.32 141.78 28.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.861 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.582 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 60.9 t -111.31 125.97 68.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -144.15 -150.69 5.3 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.757 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 66.5 mt -114.62 144.55 43.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.149 0.5 . . . . 0.0 110.969 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -137.29 137.95 39.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.677 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.45 -76.15 0.08 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.48 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -63.89 146.46 53.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.7 p -103.33 -0.66 29.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.035 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.8 p -54.97 112.26 1.01 Allowed 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.411 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 130.12 -161.55 23.08 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.52 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.447 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -118.68 -15.25 9.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 0.0 111.493 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.25 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.1 m -88.05 5.45 40.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.62 0.248 . . . . 0.0 111.613 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -110.88 132.69 53.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.103 0.478 . . . . 0.0 111.261 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.432 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.5 m95 -127.34 117.77 22.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.704 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.503 ' HG1' ' HB ' ' A' ' 184' ' ' VAL . 11.2 p -79.26 126.46 30.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.111 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.6 pt -88.5 135.13 26.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.932 0.396 . . . . 0.0 110.976 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.414 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.9 m80 -127.71 151.65 75.71 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.209 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.659 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.7 Cg_endo -68.07 140.31 49.36 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.519 2.146 . . . . 0.0 112.454 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.12 -47.27 52.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.843 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.435 ' HB3' ' NE2' ' A' ' 168' ' ' GLN . 62.2 m -111.82 -170.96 1.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.238 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.2 15.24 12.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.093 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.435 ' NE2' ' HB3' ' A' ' 166' ' ' SER . 2.4 mp0 -86.75 -35.18 19.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.21 0.529 . . . . 0.0 110.367 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.659 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -94.54 153.74 17.74 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.176 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.3 m -133.93 166.86 21.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.885 0.374 . . . . 0.0 111.342 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.03 132.2 48.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.524 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.39 -16.35 60.11 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.2 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -68.73 157.97 35.23 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.003 0.43 . . . . 0.0 111.158 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.418 ' HG2' HG23 ' A' ' 112' ' ' THR . 38.9 mttp -74.12 143.13 45.47 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.442 HG12 HD21 ' A' ' 181' ' ' LEU . 99.5 t -93.17 115.05 31.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.265 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.7 mpt_? -78.93 155.01 29.2 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-O 121.298 0.571 . . . . 0.0 111.615 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 39.0 t -69.42 121.13 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.47 -11.95 36.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.374 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -68.2 127.62 33.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.764 0.316 . . . . 0.0 110.731 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -69.7 110.36 4.85 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.442 HD21 HG12 ' A' ' 175' ' ' VAL . 71.2 mt -96.37 148.54 22.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.757 0.789 . . . . 0.0 113.127 -178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.414 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 54.5 mt -113.53 112.86 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -92.82 138.26 31.64 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.157 0.504 . . . . 0.0 112.052 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.503 ' HB ' ' HG1' ' A' ' 161' ' ' THR . 77.9 t -130.33 120.45 48.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.001 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.423 ' HG ' ' H ' ' A' ' 190' ' ' ARG . 99.9 p -61.04 123.01 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.626 178.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 89.3 t -66.59 -33.19 61.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -76.04 -39.96 54.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 49.7 m -113.95 5.37 16.14 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.91 29.86 1.79 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 34.8 mtt85 -110.34 143.21 40.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.899 0.381 . . . . 0.0 110.838 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.483 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 56.5 m-85 -74.53 153.83 38.9 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.406 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.4 tp -75.68 76.22 2.67 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 105.322 -2.103 . . . . 0.0 105.322 175.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -76.4 151.79 36.46 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -174.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.7 tp -101.12 116.21 32.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 113.604 -1.635 . . . . 0.0 107.537 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 46.8 p -109.0 146.95 33.06 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -105.77 91.08 3.6 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.53 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.32 -174.17 40.62 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.329 -0.938 . . . . 0.0 111.594 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.53 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.7 m120 -3.09 -76.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.341 0.656 . . . . 0.0 112.496 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.0 p -147.39 14.3 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.064 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.2 t -128.12 -179.7 5.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.443 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 94.2 m95 -107.36 135.22 49.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.265 0.555 . . . . 0.0 111.294 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.488 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.7 m-70 -127.93 176.79 7.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.01 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . 0.423 HG12 ' SG ' ' A' ' 47' ' ' CYS . 2.7 p -131.47 131.51 62.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.337 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -148.93 173.93 12.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.487 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -98.92 96.1 7.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.86 -179.51 3.65 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.252 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -87.97 7.21 32.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -115.39 136.21 53.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.452 . . . . 0.0 110.687 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.411 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.7 mt-30 -64.57 174.68 1.65 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.371 1.081 . . . . 0.0 112.695 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -166.61 119.38 1.02 Allowed 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.093 -1.867 . . . . 0.0 107.826 178.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 47.7 mt -73.16 128.82 36.58 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.514 -0.474 . . . . 0.0 109.948 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.3 m95 -116.2 145.05 43.41 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.596 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.8 t -112.02 100.49 8.91 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.695 HG23 ' HG ' ' A' ' 22' ' ' LEU . 97.3 t -92.52 100.66 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.75 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.24 142.25 27.73 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.087 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.53 104.33 0.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.071 1.847 . . . . 0.0 111.029 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.434 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 5.7 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.368 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.871 0.367 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -120.7 153.13 37.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.53 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.4 mt -78.16 124.37 27.98 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.8 mmm180 -111.49 158.03 19.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.982 0.42 . . . . 0.0 111.087 -179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.429 ' C ' ' H ' ' A' ' 18' ' ' ASP . 4.7 p -68.09 155.23 40.01 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.889 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.1 -7.3 1.34 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.676 -179.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.2 m-20 -68.3 136.16 53.03 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.064 0.459 . . . . 0.0 110.974 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -82.81 119.53 24.48 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.5 m -136.29 173.12 14.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.657 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.63 139.48 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.278 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.6 mp -99.97 120.56 39.99 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.672 0.272 . . . . 0.0 110.67 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.428 HE22 ' CG ' ' A' ' 57' ' ' ASN . 59.4 mt-30 -123.07 142.14 51.2 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.454 0.645 . . . . 0.0 112.185 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.446 ' SG ' HD21 ' A' ' 194' ' ' LEU . 19.6 t -127.92 146.66 50.57 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.866 178.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.0 m -87.98 122.34 31.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.267 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.419 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -113.76 122.64 47.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.347 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.2 m -125.68 140.21 52.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.447 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 tt -175.48 139.45 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.761 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.8 m80 57.86 43.19 21.99 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.409 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.5 mppt? 60.27 23.73 13.14 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.296 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -126.52 123.13 37.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.607 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -117.53 151.25 37.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.195 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -163.36 172.7 14.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.79 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HE3' HD21 ' A' ' 57' ' ' ASN . 29.2 mtmm -118.98 138.09 53.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.583 178.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -129.1 139.1 52.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.311 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.564 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 45.3 t -102.09 145.85 28.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.879 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HA ' HD22 ' A' ' 49' ' ' LEU . 30.7 tp -66.9 116.83 8.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.755 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.441 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . . . -116.48 162.44 17.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.591 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.22 165.56 21.87 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.753 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.58 144.49 39.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.569 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.91 51.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.436 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -123.24 147.59 46.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.847 0.356 . . . . 0.0 110.639 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.12 -139.81 21.58 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.411 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.3 OUTLIER -78.85 4.66 13.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.72 0.295 . . . . 0.0 110.779 179.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.48 32.42 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.908 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.412 ' H ' HD21 ' A' ' 44' ' ' ASN . 40.4 mt -77.6 139.97 39.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.032 0.444 . . . . 0.0 110.472 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.6 m -79.73 151.14 30.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.556 0.693 . . . . 0.0 111.347 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -147.05 -167.85 2.89 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.622 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.7 mt -131.0 145.67 52.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 112.321 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 46.5 mt-10 -109.07 133.76 52.57 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.921 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.454 ' HA ' HD21 ' A' ' 35' ' ' LEU . 29.9 t -77.15 121.28 23.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.544 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 53.4 p -93.62 160.62 14.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.056 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.5 t -59.67 -19.93 52.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.836 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.448 ' H ' ' HA ' ' A' ' 57' ' ' ASN . 49.4 m-20 56.15 85.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.055 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.478 ' H ' ' C ' ' A' ' 56' ' ' LYS . 8.1 m -160.39 -67.75 0.07 Allowed 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 117.446 -1.264 . . . . 0.0 112.924 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.478 ' C ' ' H ' ' A' ' 55' ' ' SER . 22.8 mtmt 48.34 77.58 0.09 Allowed 'General case' 0 C--N 1.369 1.42 0 C-N-CA 128.226 2.61 . . . . 0.0 114.598 -0.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.544 ' C ' ' HB ' ' A' ' 52' ' ' THR . 16.3 p30 -92.1 54.68 2.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.648 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.1 t -64.14 111.95 6.54 Favored Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.406 ' HA ' HG21 ' A' ' 52' ' ' THR . 7.8 Cg_exo -75.36 142.09 26.4 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.816 2.344 . . . . 0.0 110.832 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 50' ' ' GLU . 3.3 Cg_endo -46.01 -36.08 15.44 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.662 2.241 . . . . 0.0 111.711 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -140.28 92.98 2.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.226 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.519 HD12 HG12 ' A' ' 21' ' ' VAL . 57.4 tp -64.72 -32.59 74.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.836 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.2 t -51.58 -52.7 45.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.68 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 37.9 pt -71.57 -14.46 17.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.657 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.53 -3.26 46.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.428 0.632 . . . . 0.0 110.059 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.42 HG22 ' OG ' ' A' ' 124' ' ' SER . 37.7 m -84.77 134.11 34.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.123 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -137.66 162.13 34.65 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.782 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.51 HG23 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -125.62 133.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.733 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 mt -82.32 63.77 6.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.473 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.5 mm-40 -43.7 -61.03 1.53 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -178.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -124.97 163.93 21.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.708 0.766 . . . . 0.0 112.977 -177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.32 84.38 0.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.363 -1.29 . . . . 0.0 108.995 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.45 154.83 25.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.367 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.4 p -67.88 147.12 52.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.432 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.7 t -49.44 -44.99 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.088 0.47 . . . . 0.0 110.354 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -56.65 -54.21 48.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.227 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.77 97.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.9 tp -59.78 -49.3 78.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.065 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 24.4 mt-30 -62.76 -36.8 84.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.755 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -64.6 -44.04 91.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.946 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.7 mtt -62.01 -42.34 99.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.835 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.0 mt -68.92 -32.36 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.204 0.526 . . . . 0.0 110.36 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.57 69.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.661 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -76.1 -19.6 58.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.641 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 64.5 p -84.25 -6.41 59.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 0.0 111.296 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -79.6 -29.23 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.061 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -129.77 121.55 27.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 68.7 mttm 57.52 -168.16 0.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.986 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 65.6 m 61.99 105.98 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.082 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.53 169.51 17.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.074 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.22 31.63 41.72 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.829 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -68.6 -21.19 64.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 110.634 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.69 150.14 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.162 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 97' ' ' LYS . 6.9 p-10 -88.19 81.28 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.845 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.428 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.3 p -80.67 -1.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.719 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.764 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.3 mm-40 -53.72 -39.54 65.34 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.764 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -87.06 -50.77 6.42 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-N 120.45 1.477 . . . . 0.0 111.624 -2.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.632 ' H ' ' HG2' ' A' ' 97' ' ' LYS . 4.7 m-90 -66.24 -28.68 68.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.941 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.682 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -61.17 -39.47 90.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.174 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.654 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 36.3 t80 -74.28 -42.24 59.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.785 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.6 tpt -56.64 -49.42 75.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.932 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.2 mtm -71.54 -38.04 71.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -57.56 -45.76 84.75 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.859 0.361 . . . . 0.0 110.512 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.7 p -72.96 -39.28 66.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.701 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.02 69.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.074 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -91.75 -35.61 14.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.31 -18.15 78.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.266 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -139.31 61.89 0.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.953 -0.642 . . . . 0.0 112.476 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 157.69 166.7 17.53 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.395 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -75.65 -178.2 4.06 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.596 0.698 . . . . 0.0 110.83 -0.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -156.84 143.92 18.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.073 0.463 . . . . 0.0 111.533 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.3 m -75.76 148.09 38.77 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.052 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -81.34 131.63 35.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.837 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 77.9 mt -116.03 141.55 47.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.218 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.505 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 36.9 m-85 -61.56 130.71 47.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.458 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.31 -12.7 60.15 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.037 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.99 141.53 32.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.12 0.485 . . . . 0.0 111.27 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.58 127.77 33.67 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.4 pt -112.77 159.42 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.556 0.693 . . . . 0.0 112.746 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.1 tp -115.07 109.7 18.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.864 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.9 mt -97.4 116.97 30.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.629 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.51 ' NH2' HG23 ' A' ' 68' ' ' VAL . 60.4 ttp85 -103.4 116.01 31.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.777 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.476 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.5 t-80 -58.27 108.16 0.58 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 177.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.42 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -51.72 -48.33 63.64 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.476 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 68.7 t80 -61.21 -64.63 0.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.438 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 53.4 p -72.12 -19.87 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 77.9 -0.19 73.06 Favored Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.236 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.6 mtt -83.32 -165.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.411 0.148 . . . . 0.0 110.636 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.2 m-85 -133.75 138.53 45.81 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 22.1 tp -55.39 127.4 29.35 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 20.5 p -137.02 150.01 47.83 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.0 t -95.36 99.53 11.45 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.589 -1.264 . . . . 0.0 107.589 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.5 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.2 mt -75.45 152.74 37.89 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.888 -178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.6 p -78.53 -5.71 53.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.81 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 31.1 p -85.32 124.16 31.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.729 0.299 . . . . 0.0 110.884 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 51.6 m -66.74 -60.9 2.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.864 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 179.34 -43.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.593 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 p -155.52 19.6 0.4 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.667 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.2 m 61.93 14.62 6.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.192 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 76.5 p -96.73 -5.94 37.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -148.38 169.41 20.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.985 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -134.29 2.91 3.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.995 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.05 -83.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.28 151.93 19.39 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.308 0.575 . . . . 0.0 111.948 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.0 m-85 -101.23 172.46 6.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.029 177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.06 142.93 27.23 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 62.9 t -111.48 117.52 55.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.383 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.35 -150.28 5.99 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.082 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.6 mt -115.14 146.36 41.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.036 0.446 . . . . 0.0 111.029 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.474 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 7.2 tp60 -137.62 143.65 41.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.705 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.37 -50.75 12.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -81.82 143.25 31.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.434 ' HA ' ' HG ' ' A' ' 158' ' ' CYS . 77.6 p -106.49 -6.66 17.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 110.978 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 66.8 p -54.84 114.23 1.64 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.46 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.28 -158.15 21.51 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.462 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.458 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.4 mt-10 -121.11 -12.48 8.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.765 0.317 . . . . 0.0 111.357 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.57 -32.15 68.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.122 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . 0.434 ' HG ' ' HA ' ' A' ' 153' ' ' THR . 79.7 m -90.86 6.2 45.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.718 0.295 . . . . 0.0 111.593 -179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -110.07 134.07 52.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.015 0.436 . . . . 0.0 111.365 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.449 ' O ' HG12 ' A' ' 119' ' ' ILE . 51.7 m95 -128.02 117.41 21.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.611 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.405 HG23 HG21 ' A' ' 186' ' ' VAL . 13.5 p -78.84 125.89 29.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.057 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.3 pt -88.13 136.17 23.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.919 0.39 . . . . 0.0 110.89 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.4 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.23 150.17 73.29 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.605 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.5 Cg_endo -66.16 137.58 48.51 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.377 2.051 . . . . 0.0 112.407 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.51 -40.93 41.13 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.289 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 58.6 m -103.49 -173.55 2.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.406 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.411 ' O ' ' HD3' ' A' ' 167' ' ' LYS . 14.0 tmtt? -95.22 -2.12 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.931 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.09 -33.31 44.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.035 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.605 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 58.7 mmt-85 -86.88 144.86 26.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.606 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 48.8 m -127.23 167.93 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.327 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.7 134.21 51.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.1 59.5 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.285 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -67.93 156.98 36.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 63.3 mttt -73.56 141.68 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.366 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.417 HG12 HD22 ' A' ' 181' ' ' LEU . 97.4 t -91.82 113.64 27.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.358 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -78.43 154.79 30.34 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.337 0.589 . . . . 0.0 111.57 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 48.0 t -69.96 122.16 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.322 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.26 -11.55 36.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.07 127.71 33.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.891 0.376 . . . . 0.0 110.935 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.424 ' HA ' ' O ' ' A' ' 212' ' ' TRP . 6.8 m-20 -69.82 114.02 7.61 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.417 HD22 HG12 ' A' ' 175' ' ' VAL . 70.1 mt -99.78 149.5 23.29 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.471 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.9 mt -114.3 112.3 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -92.24 138.12 31.79 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.063 0.459 . . . . 0.0 112.048 -178.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.42 HG22 ' CD1' ' A' ' 191' ' ' TYR . 80.0 t -130.48 127.99 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.709 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.8 m -64.59 123.16 18.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.458 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.2 t -67.44 -30.26 48.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.832 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.9 t -79.13 -38.38 36.22 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.448 ' HB2' HH11 ' A' ' 190' ' ' ARG . 94.2 p -120.52 10.61 11.17 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 45.29 33.07 1.12 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.493 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 39.1 mtt85 -109.01 138.39 45.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.961 0.41 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.489 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 52.5 m-85 -72.2 153.06 41.83 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.404 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.4 tp -75.28 75.5 2.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -74.15 151.12 40.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -174.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.446 HD21 ' SG ' ' A' ' 24' ' ' CYS . 13.2 tp -101.53 115.8 31.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.721 -1.582 . . . . 0.0 107.645 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.4 p -109.28 145.83 35.3 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -105.7 92.45 4.18 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.73 -174.3 46.39 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.266 -0.968 . . . . 0.0 111.368 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 39.6 m-80 -1.14 -78.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.298 0.639 . . . . 0.0 112.52 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.6 p -146.68 12.87 1.16 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.07 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 49.9 m -126.74 -178.45 4.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.419 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 94.0 m95 -108.53 135.47 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.281 0.563 . . . . 0.0 111.328 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.451 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 22.8 m-70 -127.66 175.33 8.37 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.064 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.23 133.69 63.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.443 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.417 ' OD1' ' HB1' ' A' ' 206' ' ' ALA . 2.8 p30 -150.7 172.15 16.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.605 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.493 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -98.77 95.99 7.59 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.417 ' HB1' ' OD1' ' A' ' 204' ' ' ASP . . . -114.93 179.18 4.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.325 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -87.21 8.16 25.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.835 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 37.2 mt-30 -114.16 134.98 54.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.721 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.471 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.4 mt-30 -64.05 174.32 1.58 Allowed 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.296 1.046 . . . . 0.0 112.742 -178.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -167.85 121.6 0.94 Allowed 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 113.102 -1.863 . . . . 0.0 107.912 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 41.1 mt -76.37 130.31 37.88 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.122 0.487 . . . . 0.0 109.885 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.1 m95 -117.54 147.58 42.66 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.705 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -114.02 99.19 7.46 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.377 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.7 HG21 ' HG ' ' A' ' 22' ' ' LEU . 94.8 t -91.85 100.78 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.759 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.83 140.69 25.76 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.092 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.405 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.9 Cg_exo -62.1 104.69 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.079 1.853 . . . . 0.0 111.251 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.235 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.875 0.369 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -120.84 158.12 28.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.242 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.7 mt -81.96 120.5 25.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.49 HH21 ' H ' ' A' ' 109' ' ' GLY . 7.8 mmm180 -109.12 158.65 17.58 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.99 0.424 . . . . 0.0 111.035 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.463 ' HG1' ' HB2' ' A' ' 110' ' ' HIS . 4.5 p -67.75 157.22 35.19 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.793 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 69.03 -2.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.877 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.0 m-20 -74.25 134.36 42.66 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.468 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -79.68 119.37 22.52 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.469 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.9 m -136.88 169.64 19.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.653 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -132.22 140.28 48.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 108.398 176.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.689 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.8 mp -100.22 122.01 42.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.691 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.554 HE22 ' HB3' ' A' ' 57' ' ' ASN . 42.9 mt-30 -122.15 151.77 40.62 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.527 0.679 . . . . 0.0 111.889 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.1 p -137.57 140.8 41.23 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.808 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -83.26 122.82 28.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.157 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.436 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.81 120.96 40.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.4 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.3 m -125.66 140.15 52.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.428 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.1 tt -175.71 143.13 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.642 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.1 m80 58.09 39.23 26.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.749 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.25 26.22 15.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.049 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -129.26 122.84 30.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.575 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.02 149.15 39.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -161.16 174.15 14.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.67 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -120.98 135.19 55.27 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.504 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.491 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.2 mt -125.18 142.33 51.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.553 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 43.8 t -106.44 142.97 35.23 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.894 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 49' ' ' LEU . 27.0 tp -63.49 115.61 4.81 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.795 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.409 ' HB1' ' HG3' ' A' ' 50' ' ' GLU . . . -116.19 164.69 14.11 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.683 -179.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.82 165.47 9.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.683 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.93 144.64 39.15 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.627 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -82.26 17.55 17.83 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.662 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -126.75 151.95 47.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 0.0 110.446 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.15 -135.86 15.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.262 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -85.56 8.12 20.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.706 0.289 . . . . 0.0 110.78 179.649 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.0 29.23 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.922 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.438 ' H ' HD21 ' A' ' 44' ' ' ASN . 42.9 mt -78.11 142.25 38.21 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 120.974 0.416 . . . . 0.0 110.55 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.62 151.4 25.34 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.512 0.672 . . . . 0.0 111.098 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -144.9 -167.58 2.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.763 -1.108 . . . . 0.0 108.555 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.489 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.36 142.6 50.1 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.402 -0.519 . . . . 0.0 112.305 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 48.1 mt-10 -106.19 134.61 49.06 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.158 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.474 ' HA ' HD23 ' A' ' 35' ' ' LEU . 59.2 m -78.92 125.73 29.76 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.559 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 57.8 p -94.68 157.93 15.74 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 120.034 -0.666 . . . . 0.0 111.24 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -67.1 -9.43 39.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.548 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.4 ' HA ' HD21 ' A' ' 57' ' ' ASN . 85.1 m-20 59.93 14.29 4.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.941 0.4 . . . . 0.0 110.825 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 66.1 p -154.04 76.05 1.04 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.873 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 24.8 ttmm -109.09 94.2 4.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.957 0.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.559 ' C ' ' HB ' ' A' ' 52' ' ' THR . 14.8 m120 55.95 22.03 5.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.313 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 30.2 t -63.8 107.91 1.55 Allowed Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 11.9 Cg_exo -73.89 141.36 30.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.104 2.536 . . . . 0.0 111.106 177.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.81 -37.48 35.95 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.497 2.131 . . . . 0.0 111.654 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -135.3 93.73 3.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.535 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.523 HD11 HG13 ' A' ' 21' ' ' VAL . 50.5 tp -66.28 -34.12 77.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.13 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -50.07 -51.09 45.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.744 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.05 -15.97 18.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.887 0.375 . . . . 0.0 111.593 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.653 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.97 -1.52 45.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.339 0.59 . . . . 0.0 110.307 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.0 m -85.92 135.65 33.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.022 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.16 161.88 36.32 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -125.73 132.88 70.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.65 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.4 mt -82.01 66.93 7.8 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.2 mm-40 -46.28 -62.5 1.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -121.67 165.72 15.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.667 0.746 . . . . 0.0 112.963 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -158.93 82.72 0.79 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.9 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -111.37 156.55 21.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.413 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.0 t -69.77 147.15 50.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.22 -45.33 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.477 . . . . 0.0 110.254 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 ttp85 -55.5 -54.72 40.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.295 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.41 -45.17 94.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.015 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.0 tp -59.93 -46.54 89.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.394 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.99 -34.78 78.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.928 0.394 . . . . 0.0 110.772 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.77 -41.45 87.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.865 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.3 mtt -63.43 -44.05 95.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -69.66 -34.39 73.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.881 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.73 75.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -72.78 -25.35 61.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.0 p -81.66 0.87 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 111.207 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.9 t -82.85 -27.87 8.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.985 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -116.11 -70.66 0.78 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.046 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -165.16 144.87 6.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.064 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 65.0 m -146.4 -81.65 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.021 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 59.29 105.27 0.02 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.289 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 115.87 35.55 1.24 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.446 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.13 -15.45 59.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.847 0.355 . . . . 0.0 111.006 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -74.93 -168.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.406 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.572 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 5.3 m-20 -55.49 109.68 0.59 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.003 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.37 -15.42 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.033 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.706 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 12.6 mm-40 -53.88 -45.37 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 118.861 -0.59 . . . . 0.0 112.224 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.706 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.7 ptmt -86.55 -44.15 12.15 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.971 1.308 . . . . 0.0 110.826 -3.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -53.35 -49.42 67.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.219 -1.355 . . . . 0.0 112.731 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 55.3 mtpt -55.48 -30.59 60.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.667 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.678 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.2 t80 -73.81 -48.23 32.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.026 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.09 -42.51 85.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.11 -39.43 72.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.653 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -60.61 -39.91 89.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.542 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.6 m -72.39 -49.16 35.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.256 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.98 78.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.495 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -79.88 -28.7 39.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.015 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.91 -34.89 88.53 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -169.95 -176.03 39.34 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.452 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.49 ' H ' HH21 ' A' ' 15' ' ' ARG . . . -142.09 72.88 0.38 Allowed Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.73 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.463 ' HB2' ' HG1' ' A' ' 16' ' ' THR . 42.4 m-70 -87.16 -31.53 20.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 117.575 0.687 . . . . 0.0 111.048 -0.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -166.93 143.28 4.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.022 0.439 . . . . 0.0 111.462 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.5 m -75.81 148.38 38.46 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.027 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -81.74 129.58 34.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.437 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -114.92 143.13 45.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.252 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 35.6 m-85 -62.57 133.23 54.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.024 0.44 . . . . 0.0 110.471 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.7 -11.64 64.59 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.048 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.09 139.74 32.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.982 0.42 . . . . 0.0 111.356 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.26 128.71 34.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.434 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.8 pt -113.39 159.22 13.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.547 0.689 . . . . 0.0 112.792 -178.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.0 tp -115.4 108.39 16.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 48.3 mt -95.76 118.11 31.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.665 -179.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.452 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 19.7 ttp180 -103.75 115.36 30.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.669 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.1 t-80 -57.44 109.5 0.7 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.9 m -52.75 -48.81 66.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.48 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 77.4 t80 -61.6 -62.5 1.76 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.44 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 54.7 p -73.26 -20.74 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.81 -1.23 74.46 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.084 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.3 mtt -83.37 -165.92 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.461 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 60.0 m-85 -133.03 139.06 47.02 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.2 tp -54.42 129.53 36.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.4 t -138.81 147.32 42.39 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.6 t -94.04 98.05 10.74 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.479 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -73.74 156.83 37.46 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.559 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.0 m -81.61 -10.38 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.432 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -87.13 123.75 32.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.711 0.291 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 57.9 m -71.0 -60.38 2.26 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.961 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.502 ' HG3' ' H ' ' A' ' 138' ' ' SER . 10.7 ptm180 -176.11 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.157 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.502 ' H ' ' HG3' ' A' ' 137' ' ' ARG . 57.8 p -175.32 -66.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.047 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.4 m -75.42 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.063 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.7 p -72.13 169.48 15.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.214 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.423 ' HA ' ' OG ' ' A' ' 136' ' ' SER . 4.4 p30 -167.72 25.38 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -143.02 -41.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.754 -179.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 143' ' ' LEU . 3.8 mm? -60.2 -89.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -109.09 149.85 28.69 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.326 0.584 . . . . 0.0 111.759 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 15.7 m-85 -103.17 169.43 8.56 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.928 178.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -88.26 144.09 26.64 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 99.1 t -113.51 116.09 51.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.463 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.72 -147.89 5.76 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.323 -0.941 . . . . 0.0 112.695 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 70.2 mt -116.3 153.49 31.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.828 0.346 . . . . 0.0 110.618 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -143.62 139.21 29.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.81 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.96 -69.24 0.36 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.473 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.75 143.77 51.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.589 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 52.3 p -103.15 1.32 33.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.349 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -56.23 115.12 2.27 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.56 -161.89 18.9 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.613 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.476 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 33.8 mt-10 -117.07 -11.25 10.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.815 0.341 . . . . 0.0 111.273 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.71 67.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 83.8 m -92.22 9.45 33.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.22 132.5 54.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.099 0.476 . . . . 0.0 111.361 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.434 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.4 m95 -127.45 117.15 21.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.597 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 7.4 p -79.06 128.14 32.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.267 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 pt -89.48 133.41 31.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 111.052 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.441 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.5 m80 -126.57 150.15 69.99 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.2 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.646 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.3 Cg_endo -67.54 137.52 42.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.519 2.146 . . . . 0.0 112.065 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.29 -43.42 56.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.688 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 54.9 m -106.88 -174.04 2.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.039 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.63 8.06 40.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.157 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -83.83 -34.67 24.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.853 -179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.646 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -90.02 148.23 23.19 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.531 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.1 m -128.13 167.15 17.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.98 135.76 55.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 89.29 -16.88 54.85 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.395 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -67.41 154.97 40.13 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.924 0.393 . . . . 0.0 111.161 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -71.87 142.15 49.56 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 178.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 92.5 t -91.53 113.03 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.755 0.312 . . . . 0.0 110.412 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -75.51 152.96 37.75 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.34 0.591 . . . . 0.0 111.5 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 25.6 t -68.94 121.43 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.69 -11.9 35.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.342 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.36 130.34 42.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.831 0.348 . . . . 0.0 110.905 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.46 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 13.2 m-20 -71.95 112.18 7.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.401 HD13 HG21 ' A' ' 214' ' ' VAL . 76.5 mt -98.13 150.07 21.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.4 mt -114.32 112.89 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -92.75 136.28 33.38 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.191 0.52 . . . . 0.0 112.129 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 191' ' ' TYR . 73.7 t -128.74 126.27 64.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.862 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 5.3 m -63.93 125.47 24.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -70.63 -32.05 48.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.682 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.7 t -81.21 -36.31 30.23 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 53.1 m -114.98 5.51 15.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 45.22 33.16 1.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -116.09 142.47 46.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.989 0.424 . . . . 0.0 110.772 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.8 m-85 -72.6 153.84 41.06 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 27.3 tp -75.31 76.45 2.41 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 175.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -75.54 150.74 38.05 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.457 ' H ' ' HG1' ' A' ' 210' ' ' THR . 15.6 tp -101.59 114.39 28.39 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.705 177.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' SER . . . . . 0.401 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 48.2 t -107.88 146.24 32.6 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -177.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . 0.407 ' HH ' ' HA ' ' A' ' 199' ' ' SER . 80.3 t80 -106.41 91.2 3.6 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 177.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.02 -179.73 52.98 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.032 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 35.1 m-80 7.65 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.23 0.612 . . . . 0.0 112.386 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.407 ' HA ' ' HH ' ' A' ' 196' ' ' TYR . 49.7 m -142.19 5.71 1.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.349 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.1 m -120.89 -179.31 3.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.206 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.436 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.6 m95 -106.27 139.3 40.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.274 0.559 . . . . 0.0 111.198 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.44 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 32.4 m-70 -130.26 172.08 12.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.962 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.88 132.6 69.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.295 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 206' ' ' ALA . 2.8 p30 -150.31 170.19 19.6 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.588 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.49 93.77 6.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.307 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.412 ' HB2' ' OD1' ' A' ' 204' ' ' ASP . . . -113.07 175.8 5.29 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.268 -177.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.02 10.66 9.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.195 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -117.6 136.5 53.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.684 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -64.56 175.61 1.35 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.434 1.111 . . . . 0.0 113.151 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.457 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 23.7 m -169.49 120.07 0.68 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 112.919 -1.946 . . . . 0.0 107.721 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 31.6 mt -74.76 128.91 36.71 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.923 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.35 144.88 43.1 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.566 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.9 t -112.44 101.18 9.37 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.428 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.689 HG23 ' HG ' ' A' ' 22' ' ' LEU . 99.6 t -92.68 100.48 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.779 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -111.46 142.15 25.92 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.45 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.1 Cg_exo -63.68 103.73 0.41 Allowed 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.209 1.939 . . . . 0.0 111.365 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.469 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.926 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -120.35 153.61 36.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.54 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.6 mt -80.73 122.59 27.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.4 mmm180 -109.75 157.29 19.29 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 111.182 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.451 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.1 p -67.82 156.45 37.07 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.763 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.74 -9.9 1.03 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.69 -179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.451 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.9 m-20 -67.72 134.09 50.45 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -79.8 120.41 24.03 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.406 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.7 m -136.35 172.99 14.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.662 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -135.16 139.23 47.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.304 176.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.733 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.2 mp -100.04 122.62 43.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.529 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -123.04 146.02 48.03 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.625 0.726 . . . . 0.0 112.223 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -131.38 142.56 50.07 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.752 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.7 m -84.25 120.95 26.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.322 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.415 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -113.99 117.51 31.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.216 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.1 m -122.02 137.02 54.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.023 0.44 . . . . 0.0 111.731 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -171.89 144.8 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.496 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.3 m80 60.19 34.84 21.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt 64.19 25.43 13.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.133 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -128.37 126.66 41.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.177 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -116.26 141.86 47.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 111.571 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -151.59 174.39 13.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.633 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.498 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 27.7 mtmm -122.28 135.54 54.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.645 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -124.62 141.58 51.99 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.523 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.615 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.3 t -104.76 142.34 34.89 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.684 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.485 ' HA ' HD22 ' A' ' 49' ' ' LEU . 35.7 tp -60.93 112.93 2.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.684 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.73 163.4 14.19 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.515 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.73 160.21 10.39 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.405 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.7 141.85 48.78 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.622 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.82 16.36 21.11 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.193 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -122.13 148.52 44.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 0.0 110.714 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.58 -138.39 20.24 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.583 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -81.54 8.83 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.644 0.259 . . . . 0.0 110.971 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.08 31.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.249 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.9 mt -78.31 138.65 38.69 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 110.556 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.3 m -79.86 151.47 30.19 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.631 0.729 . . . . 0.0 111.413 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.71 -161.9 1.42 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.558 -1.201 . . . . 0.0 108.348 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.485 HD22 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -132.89 145.36 50.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.0 112.066 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.443 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.4 tt0 -112.69 139.36 48.36 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.526 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.412 ' HA ' HD23 ' A' ' 35' ' ' LEU . 39.5 t -78.92 144.06 35.24 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.449 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 61.6 p -104.89 153.99 20.65 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.908 0.385 . . . . 0.0 110.488 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 29.1 t -51.7 -19.36 1.56 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.605 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.8 t30 66.44 150.45 0.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.175 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 66.8 m 53.55 70.36 0.6 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.989 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.461 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 4.0 mppt? -82.12 -51.23 8.18 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 122.805 0.442 . . . . 0.0 111.097 -0.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.498 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -162.96 -96.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.052 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.0 t 61.36 101.33 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HG3' HG21 ' A' ' 52' ' ' THR . 11.0 Cg_exo -72.18 139.1 31.81 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 123.109 2.539 . . . . 0.0 111.457 178.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -51.85 -37.59 66.44 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.288 1.992 . . . . 0.0 111.451 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -122.84 84.82 2.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.783 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.574 HD12 HG13 ' A' ' 21' ' ' VAL . 44.8 tp -65.74 -30.44 71.1 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.3 p -46.83 -51.87 15.56 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 32.1 pt -71.38 -17.32 19.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.662 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.19 -1.33 42.35 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.937 0.399 . . . . 0.0 111.452 -179.233 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.409 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.1 m -84.66 132.9 34.42 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -137.07 162.91 32.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.971 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -126.27 133.92 67.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.4 mt -82.64 66.55 8.3 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.468 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 11.7 mm-40 -45.5 -64.62 0.69 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.401 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -122.98 165.26 17.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.773 0.797 . . . . 0.0 113.033 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.8 m -156.11 86.12 1.03 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.114 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.5 mt -112.96 157.09 21.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.514 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.7 t -69.65 146.86 51.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.9 t -50.36 -45.73 25.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.12 0.486 . . . . 0.0 110.236 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -57.18 -51.57 68.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.218 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -62.19 -44.63 96.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.789 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.72 -46.75 89.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.263 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -67.29 -33.6 75.64 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.925 0.393 . . . . 0.0 110.569 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.21 -41.99 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.551 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.9 mtt -64.72 -42.44 95.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.69 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.36 -32.68 71.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.656 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.29 -31.73 69.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.534 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -73.64 -17.19 61.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.244 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.6 p -92.45 -7.78 46.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.725 0.297 . . . . 0.0 111.417 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.1 t -72.39 -40.42 64.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.139 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -87.0 -174.38 4.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.773 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -60.37 -68.93 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 66.2 m 57.07 98.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.502 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -104.78 100.4 10.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.96 24.92 70.47 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.598 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -130.42 113.87 14.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.786 0.326 . . . . 0.0 110.758 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.2 p -157.63 -10.37 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -112.03 93.02 4.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.609 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.7 p -77.3 2.73 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-O 121.156 0.503 . . . . 0.0 111.353 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.714 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.8 OUTLIER -52.26 -48.99 64.93 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.916 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.714 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 89.9 mttt -89.38 -57.61 2.82 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 123.068 1.414 . . . . 0.0 108.843 -5.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -77.8 -27.39 50.11 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 112.873 -1.967 . . . . 0.0 111.655 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.0 -59.2 5.41 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.249 -0.58 . . . . 0.0 111.068 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.525 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.5 t80 -77.33 -36.01 54.27 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.919 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.4 ttt -57.26 -38.53 74.01 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.082 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.5 ttt -76.64 -42.8 40.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -57.0 -42.43 80.26 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.844 0.354 . . . . 0.0 110.249 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -72.52 -44.37 62.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.655 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.35 -31.84 66.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -80.04 -48.91 12.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.83 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.58 67.36 0.19 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.671 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -66.01 -59.13 7.8 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.89 165.06 27.94 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.413 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 42.1 m-70 -83.46 176.21 9.23 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.553 0.676 . . . . 0.0 110.753 0.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -141.09 144.94 35.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.054 0.454 . . . . 0.0 111.625 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.3 m -77.45 147.35 35.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.17 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.42 130.84 35.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 84.2 mt -114.98 142.35 46.75 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.226 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.513 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 37.3 m-85 -63.17 132.37 51.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.977 0.418 . . . . 0.0 110.388 179.576 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.47 -15.64 59.79 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.979 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -80.51 141.63 34.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.102 0.477 . . . . 0.0 111.568 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.02 127.32 33.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.132 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.0 pt -112.01 162.82 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.492 0.663 . . . . 0.0 112.761 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.401 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.9 tp -118.73 109.99 16.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.949 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -98.0 117.77 33.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.615 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.446 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.7 ttp-105 -104.08 116.15 31.7 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.45 ' HD1' ' H ' ' A' ' 126' ' ' SER . 29.2 t-80 -58.11 109.06 0.68 Allowed 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.409 ' OG ' HG22 ' A' ' 66' ' ' THR . 69.9 m -50.07 -54.13 22.43 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.423 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 46.7 t80 -57.54 -69.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.45 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 54.5 p -62.76 -29.39 70.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.73 -1.82 88.01 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.085 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 64.1 mtm -85.29 -165.69 1.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.193 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.468 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 59.0 m-85 -132.27 140.07 48.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 tp -55.03 128.46 33.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.8 t -137.97 147.7 44.51 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -176.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -94.58 97.98 10.5 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.497 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.2 mt -74.71 155.45 37.69 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.341 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -85.72 3.97 38.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.928 -178.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 64.2 p -92.2 123.72 35.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.649 0.262 . . . . 0.0 110.977 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 54.8 m -64.13 -60.9 2.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.682 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 179.66 -48.74 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.899 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.1 t -164.53 -81.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.965 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -156.87 -1.25 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.134 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 30.6 m -63.22 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.314 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -111.11 -175.44 2.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.792 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -137.32 -5.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.079 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.473 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 3.6 mm? -60.24 -92.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.02 0.438 . . . . 0.0 110.843 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . -58.6 142.48 49.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.493 0.664 . . . . 0.0 112.236 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.497 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 18.8 m-85 -101.81 173.03 6.59 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.963 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -90.98 141.99 28.25 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.7 117.68 55.71 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.346 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.84 -150.66 6.13 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.769 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 72.3 mt -114.39 148.43 37.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.902 0.382 . . . . 0.0 110.618 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -135.22 141.58 45.83 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.39 -58.7 3.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.71 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -82.64 151.69 26.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.883 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.7 p -107.33 -3.19 19.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.162 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.8 p -56.71 113.02 1.46 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.14 -159.02 22.23 Favored Glycine 0 N--CA 1.442 -0.965 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.517 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 42.1 mt-10 -120.63 -12.54 8.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.781 0.324 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.429 ' HA ' ' HG ' ' A' ' 187' ' ' SER . . . -57.87 -32.24 67.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.214 -179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.0 m -92.17 9.1 35.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -111.69 131.45 55.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.147 0.498 . . . . 0.0 111.408 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.436 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -126.47 117.52 23.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.775 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -79.07 126.4 30.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.101 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.1 pt -88.56 135.17 26.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.855 0.359 . . . . 0.0 111.009 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.462 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.6 m80 -127.25 151.58 74.8 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.149 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.632 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.5 Cg_endo -67.6 138.83 46.76 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.554 2.169 . . . . 0.0 112.275 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.72 -42.38 41.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.447 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 36.4 m -105.01 -173.09 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.416 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -95.41 6.92 47.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.475 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -86.23 -34.26 20.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.947 0.403 . . . . 0.0 110.792 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.632 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.4 mmp_? -86.78 146.52 26.21 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 33.9 t -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.429 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.84 129.08 38.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.253 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.24 -13.61 64.44 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.999 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.8 158.47 36.03 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.943 0.401 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -74.09 143.16 45.51 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 89.8 t -93.48 114.93 31.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.264 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -80.74 155.0 26.93 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 121.325 0.583 . . . . 0.0 111.709 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.84 122.82 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.54 -18.0 27.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.922 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -66.88 128.79 37.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.746 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.437 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.3 m-20 -72.99 116.54 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 61.7 mt -99.73 149.43 23.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -178.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.462 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 56.2 mt -114.31 112.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 176.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.71 137.61 32.21 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.177 0.513 . . . . 0.0 112.278 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.44 HG21 ' CD1' ' A' ' 191' ' ' TYR . 76.7 t -130.41 124.21 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.841 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 32.2 t -63.06 127.46 31.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 97.7 t -71.39 -32.26 46.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 120.896 0.379 . . . . 0.0 110.814 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' SER . . . . . 0.429 ' HG ' ' HA ' ' A' ' 157' ' ' ALA . 96.1 p -78.91 -39.42 34.87 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.482 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 55.1 m -114.06 4.91 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.32 31.15 1.7 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.301 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.473 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 0.3 OUTLIER -112.32 144.18 42.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.93 0.395 . . . . 0.0 110.69 179.868 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.462 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.8 m-85 -74.15 152.57 39.81 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.406 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 41.3 tp -75.15 77.6 2.3 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -77.75 150.44 34.38 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -174.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.8 tp -100.1 119.16 37.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.532 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.3 t -113.01 147.19 37.69 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.55 90.17 3.25 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.09 -175.03 46.32 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.17 -1.014 . . . . 0.0 111.437 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 34.8 m-80 1.11 -78.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.368 0.667 . . . . 0.0 112.496 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 34.6 t -147.05 11.38 1.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 52.2 m -125.88 -178.97 4.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.982 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.415 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 93.3 m95 -107.2 135.6 48.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.21 0.528 . . . . 0.0 111.195 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.469 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 29.9 m-70 -127.23 174.73 8.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.79 130.07 66.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.283 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -147.05 172.31 13.93 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.606 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.462 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.26 92.31 5.38 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.61 179.64 4.02 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.562 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -88.11 11.38 16.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.298 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -119.6 137.65 53.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.697 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.31 175.58 1.28 Allowed 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 122.352 1.072 . . . . 0.0 112.997 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.8 m -169.36 119.84 0.69 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.794 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 39.6 mt -74.36 129.41 37.74 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.045 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.406 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.9 m95 -116.04 146.77 41.9 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.449 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -115.02 101.89 9.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.318 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.733 HG23 ' HG ' ' A' ' 22' ' ' LEU . 61.9 t -93.49 101.58 12.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.975 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.0 143.23 29.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.098 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.47 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.38 105.26 0.59 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.237 1.958 . . . . 0.0 111.366 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.7 mm . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.94 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -119.17 157.36 28.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.504 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.8 mt -80.11 122.47 26.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 178.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.2 mmm180 -111.71 158.05 19.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.186 0.517 . . . . 0.0 111.315 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.423 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -68.06 155.79 38.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.7 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 16' ' ' THR . 7.5 m-20 71.18 -3.46 2.06 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.841 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.407 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.74 138.35 46.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -84.74 119.39 25.22 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.441 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -135.83 170.54 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -177.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.558 HG11 HD13 ' A' ' 62' ' ' LEU . 3.4 m -131.66 135.91 58.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.267 176.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.689 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -97.04 123.06 40.67 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.519 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.463 ' OE1' ' HB2' ' A' ' 57' ' ' ASN . 38.2 mt-30 -120.2 164.83 15.63 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.275 0.56 . . . . 0.0 111.355 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -151.82 142.88 23.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.49 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -86.99 119.73 27.5 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.43 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.413 ' HB3' ' CE2' ' A' ' 201' ' ' TRP . . . -113.11 119.84 39.23 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.851 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.7 m -123.88 132.01 53.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 112.037 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.418 HG21 ' CD2' ' A' ' 29' ' ' HIS . 17.7 tt -168.9 148.94 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.446 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.418 ' CD2' HG21 ' A' ' 28' ' ' ILE . 47.7 m-70 58.23 42.0 22.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 59.82 23.21 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.28 179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -126.5 145.68 50.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.412 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -130.71 142.52 50.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.924 0.392 . . . . 0.0 111.2 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.458 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -153.9 171.55 18.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.853 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -120.39 138.18 53.9 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.419 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.56 HD22 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.14 145.43 50.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.21 137.62 46.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.987 0.423 . . . . 0.0 110.549 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.503 ' HA ' HD21 ' A' ' 49' ' ' LEU . 32.4 tp -60.83 111.69 1.75 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.168 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -110.56 165.54 11.73 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.417 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.89 162.02 11.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.802 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.57 148.09 50.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.7 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.9 -0.57 89.77 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.737 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -112.22 158.02 20.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.841 0.353 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.36 -136.15 16.18 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.464 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 1.2 p30 -87.12 7.86 26.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.695 0.283 . . . . 0.0 110.877 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.87 28.84 0.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.323 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.8 mt -79.41 141.13 37.13 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.2 m -80.93 150.04 29.15 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.476 0.655 . . . . 0.0 111.245 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -144.14 -168.72 2.95 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.743 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 37' ' ' LEU . 22.7 mt -130.94 144.53 51.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.422 0.63 . . . . 0.0 112.361 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.2 mt-10 -109.12 138.44 45.47 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.819 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.56 ' HA ' HD22 ' A' ' 35' ' ' LEU . 49.7 m -81.73 134.93 35.5 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 176.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.55 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 62.0 p -105.82 165.06 11.45 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.629 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.8 m -73.47 -10.96 60.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.007 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 61.75 13.47 5.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.982 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 58.6 m -155.76 76.05 0.93 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.14 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 47.5 pttt -106.29 100.19 9.74 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.246 0.618 . . . . 0.0 110.774 -0.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.55 ' C ' ' HB ' ' A' ' 52' ' ' THR . 10.6 p30 44.8 24.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.9 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 94.4 t -64.4 108.5 1.97 Allowed Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 5.0 Cg_exo -79.7 140.23 14.62 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.839 2.359 . . . . 0.0 111.193 177.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -49.22 -40.33 42.71 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.115 . . . . 0.0 111.397 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.4 ' O ' HG12 ' A' ' 64' ' ' ILE . 13.0 t70 -128.78 92.63 3.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.709 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.558 HD13 HG11 ' A' ' 21' ' ' VAL . 50.1 tp -70.19 -29.22 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.009 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.3 m -52.32 -46.52 66.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 61' ' ' ASP . 26.3 pt -70.92 -20.34 21.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 57.1 m -97.71 13.02 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.072 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.414 HG21 ' OG ' ' A' ' 124' ' ' SER . 25.8 m -91.36 130.37 37.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.15 0.5 . . . . 0.0 111.91 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.06 161.53 35.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.108 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.66 133.34 69.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.609 178.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.404 HD11 ' HB2' ' A' ' 18' ' ' ASP . 17.1 mt -81.49 65.5 6.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.8 mm-40 -44.55 -60.23 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.2 mm-40 -126.42 163.67 22.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.706 0.765 . . . . 0.0 112.839 -177.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.6 t -155.43 84.06 1.05 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.476 -1.238 . . . . 0.0 108.999 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -111.73 152.65 27.52 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.33 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.4 t -65.4 148.55 51.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.4 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.1 t -50.44 -46.09 26.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.027 0.441 . . . . 0.0 110.288 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -55.55 -57.56 11.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.129 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.35 -44.76 84.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.177 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.8 -50.88 72.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.104 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 95.8 mt-30 -62.31 -34.57 76.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.629 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -65.74 -43.53 88.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.851 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.1 mtt -60.71 -47.08 87.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.904 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.0 mt -67.43 -34.9 78.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.981 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.95 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -69.91 -17.99 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.588 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 68.8 p -90.31 -13.69 34.7 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.716 0.293 . . . . 0.0 111.359 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.9 t -78.32 -49.01 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.89 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -92.29 -179.36 5.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 56.67 -167.67 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.9 t -146.1 -15.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.968 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -140.01 179.17 6.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 111.98 -15.29 26.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.458 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 56.36 -169.2 0.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.91 0.386 . . . . 0.0 111.156 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.4 t -73.41 -26.95 22.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.957 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 10.8 m-20 -83.27 84.78 7.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.81 -2.53 6.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.709 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 31.8 mm-40 -54.23 -44.23 71.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.735 -0.65 . . . . 0.0 112.37 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.709 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 26.1 ttmt -86.64 -50.6 6.68 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.363 1.465 . . . . 0.0 111.487 -2.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 51.6 t-105 -54.86 -36.68 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.319 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 88.0 tttt -65.75 -32.82 74.58 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.771 -178.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.695 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -74.1 -49.37 24.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.999 0.428 . . . . 0.0 109.885 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 53.7 ttp -61.06 -37.94 84.42 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.763 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttp -73.41 -40.19 64.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.983 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -61.34 -45.21 95.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.788 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 48.9 p -70.85 -45.27 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.292 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.88 -31.08 72.05 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.257 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -78.33 -60.54 2.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.973 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -145.63 57.06 0.52 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.72 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.98 -42.21 94.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.403 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -146.08 165.23 28.18 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.482 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -78.51 -177.96 5.57 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.547 0.673 . . . . 0.0 110.917 -0.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -149.45 149.56 30.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.047 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.47 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 75.0 m -78.45 147.02 34.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.286 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.0 131.55 35.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.679 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 75.2 mt -115.29 143.39 45.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.046 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.446 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 36.2 m-85 -62.79 132.68 53.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.041 0.448 . . . . 0.0 110.554 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.91 -11.84 64.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.039 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.93 141.42 32.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.038 0.447 . . . . 0.0 111.267 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.87 127.42 33.48 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 160' ' ' TRP . 49.0 pt -111.41 161.87 9.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.565 0.698 . . . . 0.0 112.692 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 24.0 tp -117.74 108.25 15.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.809 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -96.37 116.85 29.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.832 -179.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.458 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 13.4 ttp-105 -102.94 116.26 32.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.671 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.481 ' HD1' ' H ' ' A' ' 126' ' ' SER . 30.2 t-80 -58.44 108.32 0.61 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.414 ' OG ' HG21 ' A' ' 66' ' ' THR . 58.6 m -49.71 -53.09 26.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.414 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.3 t80 -58.57 -69.7 0.18 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.481 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 54.8 p -64.99 -23.75 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.27 -1.92 83.5 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.309 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.2 mtt -81.56 -164.65 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.503 0.192 . . . . 0.0 110.644 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.44 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.9 m-85 -134.77 137.87 43.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.04 129.2 29.99 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -138.26 147.6 43.85 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.7 t -94.98 96.45 9.29 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.6 mt -71.44 156.66 39.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.574 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 45.7 t -83.13 -7.31 59.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.189 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 72.5 p -88.63 121.14 30.69 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.854 0.359 . . . . 0.0 111.23 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 28.6 t -75.53 -60.31 2.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.617 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 55.55 89.89 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.126 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.6 p -162.74 -65.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.656 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.2 p -163.86 -69.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.405 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 9.1 t -87.97 -18.59 28.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.425 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 55.42 84.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.387 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -175.82 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.097 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -55.33 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.421 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -100.26 149.52 23.5 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.528 0.68 . . . . 0.0 112.158 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 18.5 m-85 -100.01 171.01 8.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.04 177.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -89.37 144.05 26.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 76.6 t -113.4 117.07 54.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.0 -147.19 5.6 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.307 -0.949 . . . . 0.0 113.006 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.443 HD13 ' HG ' ' A' ' 126' ' ' SER . 57.7 mt -117.34 147.74 42.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.94 0.4 . . . . 0.0 111.074 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -136.05 142.95 44.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.742 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -75.4 -55.77 5.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.783 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.43 145.82 30.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 0.0 110.882 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.3 p -103.59 -8.04 20.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.994 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 69.0 p -55.09 109.95 0.6 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.408 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.65 -158.36 23.21 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.42 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -122.13 -13.39 8.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.704 0.288 . . . . 0.0 111.124 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.13 67.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.094 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.9 m -91.96 8.3 38.16 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.43 132.39 54.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.106 0.479 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.458 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.74 117.89 22.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.63 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.424 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 16.0 p -78.99 125.8 29.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.172 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.4 pt -87.83 136.45 23.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.851 0.357 . . . . 0.0 110.676 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.466 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.8 m80 -129.04 150.21 74.71 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.583 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.0 Cg_endo -67.17 138.72 48.14 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.205 . . . . 0.0 112.287 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.23 66.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 63.1 m -112.82 -167.78 1.23 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.176 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -91.59 -13.35 32.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.903 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.03 -35.71 81.13 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.997 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.583 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 75.9 mmt-85 -91.31 143.87 26.19 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 56.0 m -124.82 166.4 16.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.414 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.84 131.21 45.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.545 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.41 -14.88 64.27 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.082 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -68.77 154.71 41.48 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.947 0.403 . . . . 0.0 111.043 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -70.55 142.89 51.74 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.3 t -93.03 110.92 23.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.498 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 153.23 40.14 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 121.289 0.566 . . . . 0.0 111.363 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 16.5 t -69.66 120.88 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 176.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.25 -13.75 30.96 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.304 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -67.58 132.28 47.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.321 . . . . 0.0 111.001 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.1 m-20 -73.1 116.17 13.3 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.477 HD11 HG23 ' A' ' 214' ' ' VAL . 60.7 mt -101.43 148.83 24.71 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.676 0.751 . . . . 0.0 112.964 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.466 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.9 mt -113.53 113.81 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 176.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -93.6 137.28 33.03 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.112 0.482 . . . . 0.0 112.224 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.424 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 69.5 t -130.52 125.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.793 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.6 t -63.88 125.62 24.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.853 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 98.6 t -70.14 -30.81 45.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.88 0.372 . . . . 0.0 110.711 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.2 t -81.6 -33.78 31.32 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 69.9 m -120.77 10.16 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.484 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.3 31.19 0.36 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.484 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 27.4 mtt85 -112.2 142.66 44.41 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.089 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 58.8 m-85 -73.76 152.41 40.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 36.9 tp -74.76 75.99 2.08 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.462 ' HA ' ' HG1' ' A' ' 210' ' ' THR . 81.8 t60 -75.64 149.47 38.18 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -174.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.54 116.46 31.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.753 -1.567 . . . . 0.0 107.768 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 51.7 p -110.05 146.26 35.67 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -105.68 92.67 4.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -80.82 -174.84 49.03 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.435 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.1 m-80 0.66 -79.37 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.283 0.633 . . . . 0.0 112.409 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.8 p -146.61 12.2 1.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.98 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.7 p -125.94 -179.45 4.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.413 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 94.1 m95 -106.85 136.45 46.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.18 0.514 . . . . 0.0 111.196 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.454 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 26.6 m-70 -128.66 173.01 10.68 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.009 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.02 136.43 60.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.231 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.415 ' OD1' ' HB3' ' A' ' 206' ' ' ALA . 2.8 p30 -154.0 172.24 17.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.572 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.476 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -99.15 95.2 6.93 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.095 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.415 ' HB3' ' OD1' ' A' ' 204' ' ' ASP . . . -113.72 -179.4 3.63 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.321 -177.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -88.67 8.59 27.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.178 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 47.2 mt-30 -116.02 138.19 51.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.769 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.62 175.63 2.26 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.319 1.057 . . . . 0.0 113.242 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.462 ' HG1' ' HA ' ' A' ' 193' ' ' HIS . 24.0 m -170.04 121.3 0.65 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.954 -1.93 . . . . 0.0 107.67 178.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 46.2 mt -74.68 131.42 40.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.798 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.456 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.3 m95 -118.89 127.48 53.53 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.344 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.5 t -93.16 101.45 13.74 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.318 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.689 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.9 t -93.86 102.5 13.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.663 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.18 142.03 27.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.335 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.4 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.6 Cg_exo -63.28 103.93 0.39 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.14 1.893 . . . . 0.0 111.098 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.449 HD13 ' HA ' ' A' ' 217' ' ' ILE . 4.3 mm . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.299 -179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.793 0.33 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -121.11 154.13 36.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.7 mt -79.95 122.91 27.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.404 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.5 mmm180 -110.67 157.23 19.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.105 0.479 . . . . 0.0 111.257 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.4 p -67.64 157.19 35.07 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.828 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 69.16 -2.2 1.89 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.793 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 16' ' ' THR . 5.0 m-20 -73.95 139.81 45.13 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.443 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -84.0 118.13 23.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.444 HG12 HD13 ' A' ' 69' ' ' LEU . 17.3 m -135.52 169.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.649 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -131.96 141.0 46.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 108.388 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.66 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.8 mp -100.76 120.82 40.66 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.571 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -122.19 148.58 44.77 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.698 0.761 . . . . 0.0 112.323 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.437 ' HG ' ' N ' ' A' ' 25' ' ' THR . 27.1 t -136.45 147.45 47.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.492 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.437 ' N ' ' HG ' ' A' ' 24' ' ' CYS . 25.0 m -88.99 123.49 33.36 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.552 179.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.436 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -114.42 120.86 41.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.094 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 m -126.51 133.32 51.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.766 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.409 HG21 ' CD2' ' A' ' 29' ' ' HIS . 18.4 tt -170.4 148.59 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.499 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.409 ' CD2' HG21 ' A' ' 28' ' ' ILE . 48.4 m-70 58.4 40.26 24.42 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.908 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.518 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.05 22.16 12.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.594 179.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -126.21 145.75 50.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.456 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -131.12 149.02 52.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.905 0.383 . . . . 0.0 111.196 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -161.6 169.58 21.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -116.42 138.22 51.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.526 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.6 mt -128.06 139.44 52.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.705 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.596 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 48.0 t -104.61 142.63 34.31 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.632 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.466 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.3 tp -62.27 114.85 3.71 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.751 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.403 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.67 165.04 13.22 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.5 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.56 166.27 10.1 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.715 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.59 145.75 38.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.616 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.16 17.34 33.43 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.198 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -123.44 150.27 44.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.852 0.358 . . . . 0.0 110.621 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.18 -135.8 15.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.493 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -85.12 8.7 17.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.689 0.28 . . . . 0.0 111.083 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.52 29.24 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.293 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -77.26 139.33 39.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.019 0.438 . . . . 0.0 110.546 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.3 m -81.12 151.18 28.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.593 0.711 . . . . 0.0 111.119 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -144.85 -165.65 2.21 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.61 178.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.8 mt -130.64 140.7 50.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.386 0.613 . . . . 0.0 112.083 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -107.2 140.91 39.33 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.59 179.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.403 ' HA ' HD22 ' A' ' 35' ' ' LEU . 78.9 p -81.27 138.91 35.7 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.493 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 54.6 p -102.66 169.96 8.31 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.451 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 16.0 m -56.89 -15.09 4.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 59.56 19.26 7.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.643 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.9 m -148.33 71.24 1.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.684 -0.235 . . . . 0.0 111.376 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -86.15 -27.2 24.74 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 122.91 0.484 . . . . 0.0 110.503 -0.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.493 ' C ' ' HB ' ' A' ' 52' ' ' THR . 1.5 p30 -149.77 -109.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.686 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.9 t 61.23 100.4 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.91 140.56 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 123.399 2.732 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -50.89 -39.92 58.33 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.479 2.119 . . . . 0.0 111.307 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -119.35 81.71 1.76 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.602 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.595 HD12 HG12 ' A' ' 21' ' ' VAL . 45.5 tp -63.39 -30.32 71.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.408 -178.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.2 m -46.72 -55.76 7.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 26.9 pt -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.649 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.48 -3.27 43.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 0.0 111.262 -179.363 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.8 m -83.72 134.55 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.271 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.87 164.85 27.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.02 133.64 65.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.817 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.444 HD13 HG12 ' A' ' 20' ' ' VAL . 14.7 mt -82.85 65.01 7.76 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.3 mm-40 -44.55 -59.66 2.35 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -125.93 164.19 21.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.682 0.753 . . . . 0.0 112.897 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -156.18 84.77 1.0 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.993 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.0 mt -111.84 157.92 20.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.457 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -71.64 147.87 47.09 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.6 t -49.55 -44.12 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.095 0.474 . . . . 0.0 110.247 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -58.83 -50.08 75.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.98 97.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.828 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.81 -44.19 96.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.157 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.14 -33.14 73.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.884 0.373 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.13 -41.92 85.33 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.551 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.7 mtt -64.32 -44.16 92.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.04 -31.58 69.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.823 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.85 69.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.753 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -75.44 -21.3 58.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.564 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 67.4 p -83.33 -9.65 58.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.357 . . . . 0.0 111.116 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 t -76.82 -19.49 14.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.734 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -81.13 -69.82 0.58 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.005 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -162.11 -82.1 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.99 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -169.58 165.49 10.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.733 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.35 -69.07 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.757 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.29 13.88 55.31 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.692 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -117.95 25.61 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.783 0.325 . . . . 0.0 110.79 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -57.14 -60.73 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.006 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -120.46 81.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.765 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.41 -5.2 9.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.586 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.737 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 20.9 mm-40 -53.8 -41.54 67.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.816 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.737 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 32.3 mtmm -86.61 -51.11 6.35 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 120.251 1.387 . . . . 0.0 111.326 -2.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -55.87 -40.52 73.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.847 -1.524 . . . . 0.0 112.881 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.562 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 20.8 tptm -58.18 -34.42 70.33 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.206 -179.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.711 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.0 t80 -73.44 -44.73 57.53 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 15.9 tpt -57.77 -34.37 69.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.216 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.5 mtp -73.22 -49.86 25.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -59.84 -34.69 73.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.646 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.9 m -72.65 -46.86 51.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.913 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.67 71.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -87.96 -26.99 22.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.744 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.01 -33.9 56.53 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.363 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -159.42 117.42 0.77 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.448 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 110' ' ' HIS . . . 148.2 104.42 0.34 Allowed Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.444 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.414 ' HA ' ' HA2' ' A' ' 109' ' ' GLY . 26.7 m80 -76.39 -174.33 2.82 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 117.977 0.889 . . . . 0.0 110.957 0.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 13.3 ptp180 -137.79 139.48 40.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.404 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 88.8 m -70.8 148.16 48.17 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.094 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 mp -82.19 131.33 35.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.514 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 74.5 mt -116.37 141.85 47.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.387 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.538 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 39.8 m-85 -61.36 131.86 51.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.495 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.21 -10.37 61.62 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.178 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -85.83 140.24 30.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.072 0.463 . . . . 0.0 111.365 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.439 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.88 127.53 33.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.3 pt -111.91 161.77 10.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.521 0.677 . . . . 0.0 112.732 -178.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 22.7 tp -117.49 109.31 16.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.885 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -96.67 118.11 32.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.768 -179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.432 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.6 ttp-105 -104.28 116.46 32.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.454 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.8 t-80 -58.82 107.44 0.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.3 t -49.79 -49.95 46.63 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -177.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 51.8 t80 -61.09 -67.25 0.42 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.429 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 56.0 p -68.22 -20.38 64.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.97 -0.85 71.02 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.252 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -82.67 -164.62 0.88 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.485 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.8 m-85 -133.95 138.26 45.36 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.6 tp -54.05 127.89 28.36 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.541 ' HG ' HD22 ' A' ' 133' ' ' LEU . 51.8 t -136.69 149.86 48.14 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -97.52 99.09 10.48 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.541 HD22 ' HG ' ' A' ' 131' ' ' CYS . 11.8 mt -75.9 153.5 36.66 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 54.4 m -84.01 9.95 11.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.954 -178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.2 p -94.03 124.81 38.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.0 p -61.87 -60.29 3.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -170.78 -76.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.9 p -172.78 -13.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.1 m -125.96 -173.2 2.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 62.8 m -58.95 104.68 0.25 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -164.4 157.72 17.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.984 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -154.47 -9.68 0.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.808 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.47 -81.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.357 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -94.96 149.94 20.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.386 0.612 . . . . 0.0 112.071 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.528 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.0 m-85 -100.17 170.38 8.5 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.276 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -89.26 144.3 26.2 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -113.63 117.6 55.9 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.348 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.5 -147.08 5.52 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.899 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 59.0 mt -117.42 151.28 37.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.893 0.378 . . . . 0.0 110.774 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -141.69 142.97 33.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.886 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.54 -64.11 1.1 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.566 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -73.46 145.11 45.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.664 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 60.2 p -104.05 -5.13 22.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.947 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.3 p -54.71 111.84 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.527 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.84 -160.56 22.84 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.485 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.417 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -118.53 -12.29 9.81 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.803 0.335 . . . . 0.0 111.234 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.49 66.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 77.9 m -94.55 10.86 33.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -111.8 131.64 55.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.57 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.455 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.0 m95 -127.22 116.64 20.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.662 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 8.0 p -79.25 128.6 33.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.188 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.0 pt -89.81 135.59 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 0.0 110.842 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.441 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.0 m80 -127.8 150.23 72.74 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.186 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.658 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.91 137.08 43.72 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.504 2.136 . . . . 0.0 112.297 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.01 -45.79 59.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.752 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.435 ' HB2' ' NE2' ' A' ' 168' ' ' GLN . 85.3 p -108.53 -175.59 2.82 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.262 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.74 14.83 14.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.139 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.435 ' NE2' ' HB2' ' A' ' 166' ' ' SER . 2.6 mp0 -88.21 -33.06 18.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.658 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.4 mmp_? -92.46 146.76 23.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.069 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 32.0 t -125.1 165.76 17.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.278 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.83 131.63 46.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.488 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.95 -16.43 60.91 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.049 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.1 mt-10 -67.49 155.08 39.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.042 0.448 . . . . 0.0 111.205 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -71.16 142.68 50.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.602 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.413 HG13 HD22 ' A' ' 181' ' ' LEU . 95.4 t -93.74 112.0 25.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.148 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.436 ' HD2' ' N ' ' A' ' 176' ' ' ARG . 1.2 mpt_? -78.58 154.83 30.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-O 121.388 0.614 . . . . 0.0 111.611 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 55.2 t -69.05 122.72 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.25 -12.69 36.93 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.076 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.26 126.29 29.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.787 0.327 . . . . 0.0 110.796 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 18.9 m-20 -69.49 114.77 8.03 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.413 HD22 HG13 ' A' ' 175' ' ' VAL . 60.4 mt -100.44 151.84 21.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.788 0.804 . . . . 0.0 112.998 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.441 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 57.2 mt -115.75 113.74 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.8 mp -93.48 135.32 34.84 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.201 0.525 . . . . 0.0 112.189 -178.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.411 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.1 t -127.35 126.66 68.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.739 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.4 t -67.03 124.18 22.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 98.4 t -68.64 -32.72 56.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.946 0.403 . . . . 0.0 110.968 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.2 t -78.0 -37.62 46.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 p -117.63 7.76 12.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 46.34 31.95 1.4 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 36.1 mtt85 -112.42 142.3 45.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.842 0.353 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.483 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 63.6 m-85 -74.31 154.04 39.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.4 tp -76.09 76.95 2.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.404 -2.072 . . . . 0.0 105.404 175.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.429 ' HA ' ' HG1' ' A' ' 210' ' ' THR . 81.3 t60 -76.89 150.23 36.03 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.436 HD23 ' SG ' ' A' ' 24' ' ' CYS . 13.4 tp -99.84 115.88 30.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 113.763 -1.562 . . . . 0.0 107.656 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 68.3 m -109.65 145.66 36.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -103.4 96.98 7.11 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 177.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.542 ' HA3' ' NE2' ' A' ' 202' ' ' HIS . . . -76.73 -167.03 25.67 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.04 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.461 ' C ' ' O ' ' A' ' 197' ' ' GLY . 4.4 p-10 -18.92 -63.03 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' SER . . . . . 0.442 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 86.3 p -154.7 11.59 0.37 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.217 0.532 . . . . 0.0 109.612 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.1 t -127.04 179.02 5.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.832 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 92.5 m95 -106.24 135.76 47.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.297 0.57 . . . . 0.0 111.27 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.542 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 15.1 m-70 -128.45 174.02 9.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.863 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -128.14 132.43 68.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.308 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -149.82 168.0 24.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.662 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -94.7 96.79 9.63 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.75 179.45 3.95 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.386 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -87.2 8.41 24.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.186 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -117.23 136.68 52.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.724 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -65.23 174.7 1.94 Allowed 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 122.364 1.078 . . . . 0.0 113.007 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.429 ' HG1' ' HA ' ' A' ' 193' ' ' HIS . 27.7 m -166.71 121.54 1.11 Allowed 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.99 -1.914 . . . . 0.0 107.798 178.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 51.2 mt -75.23 128.74 36.14 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.035 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.2 m95 -116.27 145.32 43.24 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.611 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 39.2 t -113.04 101.29 9.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.278 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.66 HG23 ' HG ' ' A' ' 22' ' ' LEU . 92.5 t -92.61 102.19 13.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.918 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.24 142.36 27.89 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.194 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.476 ' O ' HG12 ' A' ' 217' ' ' ILE . 22.8 Cg_exo -64.8 105.26 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.252 1.968 . . . . 0.0 111.484 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 216' ' ' PRO . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.833 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.829 0.347 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -122.7 153.05 39.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.653 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.4 mt -78.55 124.35 28.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.45 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -112.1 157.47 20.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.07 0.462 . . . . 0.0 110.952 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.477 ' HG1' ' HB3' ' A' ' 110' ' ' HIS . 9.2 p -67.64 155.38 39.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.863 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 71.02 -3.36 2.05 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.874 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -72.58 134.7 45.32 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.51 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -80.58 119.39 23.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.514 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.6 m -136.18 171.14 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.625 0.726 . . . . 0.0 112.948 -177.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.8 m -133.73 137.15 53.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.271 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.67 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.1 mp -97.73 121.77 40.04 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.613 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.588 ' NE2' HG23 ' A' ' 52' ' ' THR . 80.3 mt-30 -121.34 156.0 33.54 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.352 0.596 . . . . 0.0 111.538 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.451 ' HG ' HD21 ' A' ' 194' ' ' LEU . 21.5 t -143.7 144.48 31.88 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.368 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -86.14 124.98 33.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.445 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.441 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -116.36 119.53 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.034 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.2 m -122.46 139.38 53.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.781 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.2 tt -178.38 144.55 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.671 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.1 m80 59.11 41.15 21.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.318 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.3 20.98 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.626 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -127.81 134.28 49.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 110.672 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -124.02 146.22 48.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.056 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -156.21 171.62 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.857 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HZ2' ' HB3' ' A' ' 57' ' ' ASN . 40.1 mtmt -117.87 136.37 53.5 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.464 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.07 143.02 51.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.44 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.597 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 50.9 t -107.64 142.67 37.24 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.649 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.455 ' HA ' HD22 ' A' ' 49' ' ' LEU . 30.3 tp -62.35 114.51 3.53 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.72 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -114.48 164.28 14.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.434 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 166.79 10.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.686 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.23 151.26 47.5 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.687 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.12 -6.92 87.66 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.624 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -107.82 163.07 13.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.11 -142.03 25.82 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.401 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.2 p30 -84.09 9.68 11.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 110.622 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.61 29.28 0.4 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.949 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.4 mt -79.37 139.17 37.82 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.97 0.414 . . . . 0.0 110.621 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.6 m -80.25 149.84 30.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.545 0.688 . . . . 0.0 111.131 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -144.17 -166.97 2.49 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.591 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.4 mt -129.79 141.43 50.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.336 0.588 . . . . 0.0 112.266 -178.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.43 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 mt-10 -107.88 139.06 43.05 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.755 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.424 ' HA ' HD21 ' A' ' 35' ' ' LEU . 50.1 m -80.68 140.23 35.74 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.588 HG23 ' NE2' ' A' ' 23' ' ' GLN . 51.8 p -103.69 160.99 14.29 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.585 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.5 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 10.9 t -49.24 -29.13 5.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.93 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.7 t30 62.96 0.23 0.68 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.564 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.444 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 74.5 p -143.91 62.12 1.36 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.09 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.444 ' HA ' ' N ' ' A' ' 55' ' ' SER . 94.1 mttt -114.44 133.45 55.73 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.292 0.637 . . . . 0.0 110.708 -0.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 53' ' ' SER . 6.0 p30 41.86 -132.27 0.44 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.387 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t 61.75 102.34 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -75.92 139.78 22.34 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 123.231 2.621 . . . . 0.0 111.556 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -51.05 -37.94 58.42 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.388 2.059 . . . . 0.0 111.541 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -121.26 81.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.589 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.556 HD13 HG13 ' A' ' 21' ' ' VAL . 44.6 tp -62.9 -30.93 71.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.492 -178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.9 m -47.62 -54.88 10.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.0 pt -68.54 -16.9 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.01 -0.39 47.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.075 0.464 . . . . 0.0 111.305 -179.183 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.3 m -85.27 134.12 34.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.349 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -138.27 162.5 34.18 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.101 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.511 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.8 134.57 65.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.71 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.25 64.93 8.01 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 9.8 mm-40 -44.25 -62.9 1.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 56.7 mm-40 -122.91 163.08 21.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.705 0.764 . . . . 0.0 112.897 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -155.34 85.08 1.06 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.478 -1.237 . . . . 0.0 108.951 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.33 158.14 20.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.8 p -71.13 146.83 48.95 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.1 t -49.92 -45.72 22.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.083 0.468 . . . . 0.0 110.195 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.2 ttp85 -55.44 -54.24 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.454 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.97 -45.31 95.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.821 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.4 tp -59.06 -44.55 91.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.281 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 97.1 mt-30 -67.95 -34.82 77.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -66.12 -41.07 91.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.738 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.2 mtt -64.62 -44.92 89.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.5 mt -67.66 -34.82 77.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.08 -33.3 74.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -72.92 -18.76 61.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.559 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 80.9 p -91.22 -4.37 56.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.602 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -77.34 -26.72 15.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.36 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -104.9 147.99 27.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.858 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -82.16 99.85 9.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 59.1 p -141.01 -63.77 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.698 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 55.44 -164.28 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.142 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 108.97 -10.91 34.43 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.587 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -83.89 89.12 7.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.855 0.359 . . . . 0.0 110.791 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.7 m -141.23 -175.45 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.999 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 97' ' ' LYS . 5.4 p-10 -82.61 77.54 9.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.499 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 19.4 m -83.42 1.65 3.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.701 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.791 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 3.2 mm-40 -54.01 -37.91 64.55 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.789 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.791 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 54.0 pttt -87.5 -50.98 6.18 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 120.372 1.442 . . . . 0.0 111.691 -3.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.403 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.7 p-90 -63.99 -28.8 70.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.948 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -61.8 -41.66 98.02 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.776 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.691 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.3 t80 -74.18 -45.17 50.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.123 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.4 ttp -56.57 -42.86 79.32 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.653 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.2 mmt -73.55 -40.07 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.163 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.51 -45.8 84.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.891 0.377 . . . . 0.0 110.626 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.434 ' HG1' ' H ' ' A' ' 105' ' ' ALA . 52.4 p -70.09 -47.05 63.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.893 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.434 ' H ' ' HG1' ' A' ' 104' ' ' THR . . . -62.08 -23.53 66.57 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.09 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -88.05 -35.66 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.84 -66.85 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.345 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 56.83 -97.12 0.06 OUTLIER Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.732 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.406 ' HA3' ' HA ' ' A' ' 110' ' ' HIS . . . -137.42 -164.21 9.97 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.477 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 17.6 m80 -108.32 -164.05 0.93 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 117.953 0.877 . . . . 0.0 110.609 0.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.423 ' H ' ' HG1' ' A' ' 16' ' ' THR . 13.0 ptp180 -152.55 142.13 21.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.01 0.433 . . . . 0.0 111.115 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.45 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 63.1 m -71.64 147.23 47.72 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.255 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.63 131.39 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.424 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.5 mt -115.58 141.58 47.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.291 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.47 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 38.9 m-85 -61.98 129.58 41.58 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.983 0.42 . . . . 0.0 110.491 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.78 -13.14 57.88 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.051 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.49 140.89 33.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.04 0.448 . . . . 0.0 111.324 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.12 126.25 31.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.6 pt -112.06 158.26 12.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.527 0.679 . . . . 0.0 112.77 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.6 tp -114.26 109.97 19.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.966 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 53.5 mt -97.0 116.48 29.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.688 -179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.511 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.9 ttp85 -102.85 117.11 33.91 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.795 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.482 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.1 t-80 -59.72 108.58 0.76 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.0 t -53.02 -45.31 67.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.482 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 53.7 t80 -65.16 -57.56 8.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.21 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.435 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 57.8 p -79.82 -15.39 57.51 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.63 -0.49 56.03 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.432 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.6 mtt -83.23 -165.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.466 0.175 . . . . 0.0 110.566 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.476 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 70.4 m-85 -134.09 138.11 45.06 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.97 125.62 21.11 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.426 ' HG ' ' HG ' ' A' ' 158' ' ' CYS . 40.7 t -134.37 146.92 50.36 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . 0.44 ' HB2' ' HG ' ' A' ' 185' ' ' SER . 49.7 t -93.6 97.18 10.32 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.468 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -73.66 153.26 40.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.467 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.0 t -83.6 2.88 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.814 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 50.2 p -89.79 122.49 32.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.771 0.319 . . . . 0.0 110.909 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 57.5 m -62.73 -58.86 5.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.747 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.508 ' HG3' ' HZ1' ' A' ' 142' ' ' LYS . 40.9 mmt180 -140.52 -70.99 0.37 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.058 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.7 t -158.44 -51.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.986 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.4 m -123.17 -36.63 2.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.073 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.0 t -87.25 163.58 16.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.094 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -124.41 102.03 7.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.974 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.508 ' HZ1' ' HG3' ' A' ' 137' ' ' ARG . 36.9 mtmm -111.56 -167.88 1.24 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.433 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 3.5 mm? -57.82 -85.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.271 0.558 . . . . 0.0 111.143 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.448 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . -49.93 148.23 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.206 -178.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.7 m-85 -104.45 177.06 4.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.425 -1.261 . . . . 0.0 108.692 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -94.18 141.62 28.34 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 65.4 t -112.43 116.98 54.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.32 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.39 -147.9 5.8 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.758 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.1 mt -116.74 151.89 35.46 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.87 0.366 . . . . 0.0 110.58 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.23 136.08 31.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.805 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -69.45 -46.84 65.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.15 147.75 25.48 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.754 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.4 p -107.03 -7.6 16.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.6 p -53.87 116.78 2.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.502 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.21 -161.52 19.69 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.686 -0.769 . . . . 0.0 111.495 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.448 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.3 mt-10 -118.34 -15.19 9.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.741 0.305 . . . . 0.0 111.271 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.3 -32.17 68.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.126 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . 0.426 ' HG ' ' HG ' ' A' ' 131' ' ' CYS . 78.3 m -88.15 4.5 45.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.478 -179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -109.8 135.35 50.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.044 0.449 . . . . 0.0 111.207 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.415 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.0 m95 -128.74 116.57 19.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.604 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.8 p -78.59 124.6 28.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 pt -87.16 136.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.828 0.347 . . . . 0.0 110.936 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.424 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.06 150.03 72.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.563 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.8 Cg_endo -66.26 138.22 50.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.497 2.131 . . . . 0.0 112.483 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.18 -43.39 52.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.581 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 50.4 m -105.1 -170.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.286 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -92.44 -12.53 31.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -67.38 -35.48 79.41 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.318 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.563 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.2 mmt-85 -87.47 146.04 26.01 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.3 t -128.68 168.22 16.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.899 0.38 . . . . 0.0 111.411 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.71 132.28 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.151 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.56 -14.63 64.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.947 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -70.75 155.7 40.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.011 0.434 . . . . 0.0 111.258 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -71.53 144.13 49.71 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.48 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.406 HG11 HD23 ' A' ' 181' ' ' LEU . 80.0 t -94.84 111.14 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.409 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.89 154.54 35.95 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.399 0.618 . . . . 0.0 111.572 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.48 123.0 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.326 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -18.21 30.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -63.95 130.3 43.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.721 0.296 . . . . 0.0 110.739 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.605 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -72.34 115.31 11.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.406 HD23 HG11 ' A' ' 175' ' ' VAL . 66.8 mt -99.5 147.37 25.37 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.745 0.783 . . . . 0.0 112.911 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.424 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 58.4 mt -112.81 112.29 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.47 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.6 mp -92.49 136.67 33.01 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.943 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.42 HG21 ' CD1' ' A' ' 191' ' ' TYR . 83.4 t -130.46 125.51 59.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.793 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.44 ' HG ' ' HB2' ' A' ' 132' ' ' CYS . 17.9 m -61.2 129.0 39.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.448 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.3 t -72.54 -32.48 41.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.548 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 42.4 t -79.93 -37.28 34.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.532 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 50.5 m -114.07 0.5 14.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.18 27.59 3.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 179.466 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.433 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 1.9 mtt-85 -108.14 142.41 38.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.03 0.443 . . . . 0.0 111.124 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.2 m-85 -72.95 153.14 41.09 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.0 tp -75.76 74.86 2.73 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -74.2 150.17 40.5 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -174.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.451 HD21 ' HG ' ' A' ' 24' ' ' CYS . 12.5 tp -99.82 116.22 31.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.522 176.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.3 t -110.05 147.8 32.9 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -107.64 89.76 3.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.75 -174.94 45.43 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.361 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 22.6 m-80 1.75 -79.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.435 0.694 . . . . 0.0 112.401 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 38.8 t -146.95 11.56 1.07 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.0 t -125.45 -179.17 4.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.752 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.441 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.3 m95 -107.24 136.08 47.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.27 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.459 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 27.9 m-70 -127.9 173.29 10.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.007 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.8 p -127.75 131.63 69.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.103 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.2 173.45 12.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.809 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.04 91.36 4.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.165 178.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -109.89 -179.82 3.91 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -88.18 7.7 30.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.214 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -116.51 137.33 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.608 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -64.73 175.44 1.46 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.399 1.095 . . . . 0.0 113.287 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -169.71 120.78 0.68 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.895 -1.957 . . . . 0.0 107.842 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.605 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 42.0 mt -74.47 132.8 42.21 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.937 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.414 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.9 m95 -121.31 118.24 29.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.489 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 23' ' ' GLN . 33.7 p -85.4 101.44 12.6 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.059 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.67 HG23 ' HG ' ' A' ' 22' ' ' LEU . 84.6 t -92.78 104.81 16.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.86 139.42 23.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.249 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.434 ' O ' HG12 ' A' ' 217' ' ' ILE . 33.1 Cg_exo -62.16 105.81 0.42 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.09 1.86 . . . . 0.0 111.266 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.514 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.156 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.425 HE21 ' N ' ' A' ' 12' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.778 0.323 . . . . 0.0 110.566 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -120.56 151.09 39.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.46 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.3 mt -76.64 128.32 34.48 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 9.7 mmt85 -116.53 157.78 24.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.328 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.432 ' C ' ' H ' ' A' ' 18' ' ' ASP . 10.7 p -68.29 155.51 39.59 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.748 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.93 -8.26 1.31 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 16' ' ' THR . 3.0 m-20 -69.15 143.02 54.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 15.3 tt0 -89.57 116.29 27.61 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.487 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -132.54 175.65 10.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -135.15 142.03 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.575 176.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.699 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.8 mp -103.53 117.91 35.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.427 ' NE2' HG23 ' A' ' 52' ' ' THR . 42.5 mt-30 -118.97 149.94 40.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.674 0.75 . . . . 0.0 112.458 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.1 p -137.26 142.59 41.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.558 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.9 m -84.85 121.97 28.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.475 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.452 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -112.77 120.07 40.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.095 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 m -125.46 134.16 52.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.539 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -170.77 145.43 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.486 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.5 m80 58.26 39.12 25.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.793 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.481 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 61.45 25.61 15.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.258 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -127.33 133.47 50.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.282 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -122.64 148.71 44.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.474 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -161.85 173.1 15.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.553 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -120.53 136.54 54.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.569 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -125.78 141.03 52.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.533 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.627 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 51.4 t -104.75 146.23 29.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.491 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.453 ' HA ' HD21 ' A' ' 49' ' ' LEU . 31.9 tp -65.34 112.6 3.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.943 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB3' HD13 ' A' ' 64' ' ' ILE . . . -111.51 163.8 13.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.571 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.4 164.92 10.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.703 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.07 143.53 42.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.69 179.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.22 18.73 21.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.277 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -124.72 147.55 48.56 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.42 -138.75 20.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.485 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -80.51 7.56 9.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.734 0.302 . . . . 0.0 110.787 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.44 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.77 32.44 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.095 179.619 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -78.08 137.61 38.32 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 110.449 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -78.85 150.81 32.15 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.583 0.706 . . . . 0.0 111.449 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 p90 -145.21 -166.28 2.38 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.488 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.8 mt -129.09 142.51 50.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.403 0.62 . . . . 0.0 112.096 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 tt0 -110.64 138.47 46.99 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.797 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.426 ' O ' ' HD2' ' A' ' 60' ' ' PRO . 49.3 m -76.66 146.08 38.36 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 76.7 p -104.59 120.86 42.27 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.995 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 19.2 t 17.02 54.7 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 O-C-N 124.306 1.004 . . . . 0.0 112.789 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 51.14 -88.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.336 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.417 ' N ' ' O ' ' A' ' 53' ' ' SER . 72.3 p -116.68 99.28 7.02 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.931 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -153.61 13.99 0.48 Allowed 'General case' 0 C--N 1.344 0.331 0 C-N-CA 123.205 0.602 . . . . 0.0 110.712 0.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.457 ' O ' ' HB3' ' A' ' 53' ' ' SER . 21.9 p-10 -132.13 176.99 7.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.0 t 61.3 104.1 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.532 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 2.8 Cg_exo -76.72 139.5 20.04 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 123.211 2.607 . . . . 0.0 111.5 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.426 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.4 Cg_endo -51.36 -39.22 63.59 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.383 2.055 . . . . 0.0 111.315 179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -121.71 84.34 2.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.686 179.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.587 HD12 HG12 ' A' ' 21' ' ' VAL . 46.1 tp -64.91 -30.73 71.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.17 -178.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.1 m -46.69 -54.0 10.53 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.455 HD13 ' HB3' ' A' ' 38' ' ' ALA . 29.9 pt -69.01 -18.71 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.87 -2.21 47.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.068 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.4 m -84.7 133.01 34.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.387 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.88 162.69 33.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -126.42 133.64 68.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.786 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 18' ' ' ASP . 15.0 mt -82.69 65.4 7.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.49 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 8.8 mm-40 -45.01 -61.22 1.71 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -124.57 164.66 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.651 0.739 . . . . 0.0 112.796 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.507 ' HG ' HG22 ' A' ' 119' ' ' ILE . 57.1 m -157.47 86.73 0.94 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.03 178.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.17 154.84 28.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.271 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.7 t -68.55 150.49 47.97 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -51.82 -43.51 34.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.078 0.466 . . . . 0.0 110.162 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.405 ' HB3' ' NH1' ' A' ' 76' ' ' ARG . 18.4 ttp-105 -56.58 -57.13 13.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.912 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.61 89.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.091 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.6 tp -61.83 -46.49 89.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.256 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -66.63 -33.0 74.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.958 0.409 . . . . 0.0 110.488 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -66.66 -42.84 85.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.681 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -64.44 -42.42 95.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.757 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.3 mt -69.17 -33.39 73.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.75 -31.81 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.6 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -71.27 -24.08 62.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.46 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.6 p -82.54 -7.19 59.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.845 0.355 . . . . 0.0 111.32 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -88.88 -24.98 5.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.975 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.69 -68.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.171 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -149.41 -61.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.808 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.4 p -60.59 132.28 53.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.735 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -155.43 122.1 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.792 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 99.12 15.45 33.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -143.4 151.17 40.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.742 0.306 . . . . 0.0 110.774 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.87 -34.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -76.11 85.37 2.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.832 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.7 m -86.04 -5.25 9.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.772 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.723 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.0 mm-40 -53.8 -41.69 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 118.666 -0.683 . . . . 0.0 112.635 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.717 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 27.3 tttm -86.32 -50.86 6.62 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 125.469 1.508 . . . . 0.0 111.641 -2.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -57.53 -35.52 70.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.041 -1.436 . . . . 0.0 113.264 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 12.8 mmmm -64.18 -33.77 76.56 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.45 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.723 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 7.7 t80 -74.17 -49.43 23.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.224 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 50.0 ttm -59.45 -44.32 92.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.219 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.4 ttt -70.15 -49.25 52.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.534 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.8 -38.4 75.45 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.047 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 -46.77 57.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.83 -54.35 48.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.572 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -70.92 -34.06 71.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.087 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.82 3.08 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.373 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 60.06 46.2 94.6 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.687 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 132.31 175.94 14.2 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.674 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -151.73 166.96 29.72 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.381 0.59 . . . . 0.0 110.833 0.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -159.89 150.72 19.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.019 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 84.4 m -78.98 144.28 34.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.411 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.09 130.39 35.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.4 mt -115.15 142.36 46.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.332 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.11 130.74 46.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.044 0.45 . . . . 0.0 110.529 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.6 -13.04 59.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.069 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -83.05 140.02 32.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.022 0.439 . . . . 0.0 111.456 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.99 128.18 33.82 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.507 HG22 ' HG ' ' A' ' 72' ' ' SER . 44.5 pt -112.65 159.72 12.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.649 0.738 . . . . 0.0 112.935 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.4 tp -115.66 107.19 14.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.686 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.1 mt -95.37 117.62 30.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.74 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.492 ' NH2' HG21 ' A' ' 68' ' ' VAL . 62.3 ttp85 -104.04 116.04 31.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.696 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.449 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.6 t-80 -57.69 110.71 0.94 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.9 t -52.76 -52.46 56.42 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.449 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 48.6 t80 -57.73 -66.9 0.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.449 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 60.0 p -66.72 -33.06 74.81 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.02 -3.11 80.44 Favored Glycine 0 C--N 1.322 -0.204 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.676 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.402 ' H ' ' HG ' ' A' ' 126' ' ' SER . 48.3 mtt -81.94 -165.5 1.0 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.716 -0.242 . . . . 0.0 110.434 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.49 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.7 m-85 -133.46 139.25 46.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.404 HD11 HD22 ' A' ' 37' ' ' LEU . 26.0 tp -54.66 127.14 26.77 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.485 ' HG ' HD22 ' A' ' 133' ' ' LEU . 52.8 t -136.5 143.99 44.07 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -91.82 97.83 11.23 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.5 mt -73.76 145.31 45.18 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.522 -178.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.5 p -76.71 -0.04 22.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.757 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.6 p -91.25 120.44 32.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 110.94 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 49.4 m -63.05 -56.61 15.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -152.47 -23.49 0.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.795 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.8 p -147.77 -64.02 0.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.036 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.7 p -165.1 -7.43 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.8 t -92.42 164.86 13.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -91.66 131.53 36.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.73 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 136' ' ' SER . 35.1 mmtp -140.63 -170.94 3.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.927 0.394 . . . . 0.0 111.343 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.52 -61.46 2.61 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.396 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.7 157.21 17.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.139 -178.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.516 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 14.5 m-85 -103.85 172.72 6.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.995 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.26 144.63 25.67 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 120.995 0.426 . . . . 0.0 109.867 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 74.8 t -114.13 117.9 56.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.288 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.84 -150.44 5.81 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.008 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 65.7 mt -114.89 151.96 33.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.925 0.393 . . . . 0.0 110.776 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -140.14 142.76 35.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.859 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.61 -51.62 11.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.529 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -83.27 146.25 28.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.0 p -106.54 -7.72 17.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 65.8 p -54.73 114.07 1.56 Allowed 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.49 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.06 -160.06 21.84 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.706 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.417 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.6 mt-10 -118.85 -14.85 9.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.745 0.307 . . . . 0.0 111.429 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.3 -34.35 66.41 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.4 m -89.51 8.01 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -111.02 133.51 53.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.104 0.478 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.425 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.3 m95 -128.13 115.98 19.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.741 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 13.5 p -78.35 126.36 30.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.208 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.3 pt -88.38 136.18 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -129.25 151.47 77.84 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.187 -179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.635 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.67 140.16 55.47 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.593 2.195 . . . . 0.0 112.397 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.73 51.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.746 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 7.7 t -110.79 -168.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.441 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -95.57 4.75 52.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.333 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -84.04 -30.65 25.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.905 0.383 . . . . 0.0 111.004 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.635 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.0 mmt-85 -92.27 144.23 25.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.7 m -124.94 164.79 19.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.935 0.397 . . . . 0.0 111.64 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 130.64 43.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.317 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.7 -16.95 60.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.027 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -67.79 156.18 37.62 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.952 0.406 . . . . 0.0 111.093 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -72.23 144.67 48.37 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.448 HG12 HD22 ' A' ' 181' ' ' LEU . 95.5 t -94.68 113.23 28.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -77.0 155.0 32.91 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.649 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 22.8 t -69.93 119.91 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.94 -13.76 31.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.309 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -66.38 132.48 48.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.813 0.339 . . . . 0.0 110.932 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.494 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.2 m-20 -73.49 110.46 7.8 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.747 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.467 HD12 HG21 ' A' ' 214' ' ' VAL . 56.6 mt -97.34 150.64 20.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.748 0.785 . . . . 0.0 112.985 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.488 HD12 ' NE2' ' A' ' 209' ' ' GLN . 48.0 mt -115.61 113.07 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 176.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.64 136.37 33.28 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.028 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.423 HG21 ' CD1' ' A' ' 191' ' ' TYR . 76.1 t -128.47 127.61 67.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.812 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 6.6 m -65.3 125.08 23.95 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.1 t -69.54 -30.36 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.963 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 94.1 p -79.94 -37.0 35.42 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.417 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 73.9 p -120.2 9.31 11.06 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 46.26 31.96 1.37 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.386 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.41 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 24.2 mtt180 -111.05 140.42 45.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.085 0.469 . . . . 0.0 110.983 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.487 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.5 m-85 -72.84 153.61 40.98 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.6 tp -75.57 75.93 2.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 175.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.26 151.07 38.41 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 115.68 1.734 . . . . 0.0 115.68 -174.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.2 tp -100.42 117.45 34.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.585 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 34.1 t -112.03 146.03 38.63 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -105.32 92.67 4.3 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.531 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -173.85 44.76 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.375 -0.916 . . . . 0.0 111.419 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.531 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.1 m120 -3.28 -76.3 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.362 0.665 . . . . 0.0 112.51 -179.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 78.2 p -147.7 13.72 1.05 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.116 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.1 t -128.42 179.45 5.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.452 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.9 m95 -106.07 136.45 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.219 0.533 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.462 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 23.0 m-70 -128.19 173.11 10.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.029 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.7 p -127.57 131.06 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.146 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -147.52 173.11 12.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.683 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.22 93.91 5.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.152 178.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -112.98 176.86 4.84 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.304 -177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -85.69 10.11 14.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.072 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -118.09 134.59 54.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.488 ' NE2' HD12 ' A' ' 182' ' ' ILE . 95.4 mt-30 -63.62 174.7 1.27 Allowed 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 122.389 1.09 . . . . 0.0 113.133 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.4 m -167.52 120.82 0.94 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.939 -1.937 . . . . 0.0 107.734 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.494 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.6 mt -74.53 128.76 36.34 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.004 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.419 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.3 m95 -115.78 147.31 41.1 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.498 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.3 t -113.62 98.57 7.14 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.326 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.699 HG23 ' HG ' ' A' ' 22' ' ' LEU . 99.1 t -91.63 100.45 11.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -117.6 135.79 23.39 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.478 ' HA ' HG13 ' A' ' 20' ' ' VAL . 17.5 Cg_endo -60.07 107.14 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 121.835 1.69 . . . . 0.0 111.135 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.487 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.6 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.121 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.548 HE21 ' HB ' ' A' ' 177' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.829 0.347 . . . . 0.0 110.688 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -122.0 153.89 37.96 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.097 179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 25.4 mt -80.53 121.94 26.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.493 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -110.96 157.89 19.39 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.09 0.472 . . . . 0.0 111.287 -179.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 p -67.62 156.2 37.38 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.661 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 71.58 -4.25 1.93 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.818 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.402 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.9 m-20 -73.15 133.01 43.94 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.691 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.84 121.36 25.86 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.7 m -136.93 173.93 12.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.602 HG11 HD13 ' A' ' 62' ' ' LEU . 3.4 m -135.62 136.76 50.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.251 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.705 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.6 mp -97.49 122.92 41.1 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.672 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.439 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 38.6 mt-30 -122.84 149.29 44.37 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 112.029 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.507 ' HG ' HD12 ' A' ' 194' ' ' LEU . 26.4 p -136.18 144.07 44.76 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.627 178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.4 m -86.72 122.06 30.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.431 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -113.04 120.51 41.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.065 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.8 m -124.15 132.29 53.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.039 0.447 . . . . 0.0 111.761 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.46 HG23 ' HD1' ' A' ' 29' ' ' HIS . 17.1 tt -169.3 146.0 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.507 179.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.46 ' HD1' HG23 ' A' ' 28' ' ' ILE . 54.5 m80 59.79 39.66 20.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.074 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.7 mppt? 61.3 21.52 12.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.372 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -124.94 144.66 50.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -131.5 146.33 52.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.978 0.418 . . . . 0.0 111.384 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' ' 33' ' ' GLN . 2.2 pt20 -157.38 170.25 22.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.604 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.481 ' HZ2' ' ND2' ' A' ' 57' ' ' ASN . 27.7 mtmm -118.42 137.25 53.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.569 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 23' ' ' GLN . 1.4 mt -125.71 143.68 50.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.601 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.4 p -107.94 139.72 42.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 0.0 110.435 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HA ' HD22 ' A' ' 49' ' ' LEU . 34.4 tp -60.23 109.81 1.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.008 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.446 ' HB2' HD11 ' A' ' 64' ' ' ILE . . . -109.06 164.34 12.51 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.6 -179.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.16 162.03 10.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.766 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.95 142.83 44.63 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.557 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.22 23.17 8.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.366 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -130.57 147.12 52.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.872 0.367 . . . . 0.0 110.561 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.57 -125.34 6.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.519 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -93.56 8.02 42.35 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.749 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.16 31.88 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.296 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.5 mt -80.41 134.39 36.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.602 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.53 149.72 38.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.65 0.738 . . . . 0.0 111.163 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -146.07 -166.09 2.37 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.265 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.491 HD22 ' HA ' ' A' ' 37' ' ' LEU . 24.7 mt -128.94 145.19 51.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.386 0.613 . . . . 0.0 111.736 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 tt0 -113.23 136.61 52.55 Favored 'General case' 0 CA--C 1.5 -0.951 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.767 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.455 ' O ' ' HD2' ' A' ' 60' ' ' PRO . 43.9 t -75.88 145.12 40.77 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.568 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 78.0 p -104.15 125.12 50.2 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.683 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 52' ' ' THR . 27.7 p 18.81 55.17 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.209 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 59.88 -81.01 0.02 OUTLIER 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.713 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 67.5 m -157.17 103.82 2.03 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.978 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.662 ' HB2' ' HZ3' ' A' ' 56' ' ' LYS . 9.7 mtmp? -143.38 -173.31 3.9 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 123.623 0.769 . . . . 0.0 110.548 -0.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.481 ' ND2' ' HZ2' ' A' ' 34' ' ' LYS . 26.7 m-80 63.48 162.63 0.11 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.344 0.592 . . . . 0.0 112.258 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.6 t 60.51 99.47 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 6.3 Cg_exo -79.85 139.95 14.2 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 123.352 2.702 . . . . 0.0 111.326 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 51' ' ' SER . 8.8 Cg_endo -51.44 -39.7 63.77 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.358 2.038 . . . . 0.0 111.399 179.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -122.84 84.98 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.777 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.602 HD13 HG11 ' A' ' 21' ' ' VAL . 46.4 tp -67.02 -27.46 67.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.283 -178.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.4 m -49.73 -51.76 36.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.446 HD11 ' HB2' ' A' ' 38' ' ' ALA . 27.8 pt -67.38 -18.4 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -178.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 58.4 m -100.63 14.15 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.652 0.263 . . . . 0.0 111.334 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -91.86 129.82 37.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -136.93 158.7 43.85 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.138 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 t -122.8 132.7 70.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.694 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.9 mt -80.73 67.59 6.66 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 12.1 mm-40 -46.81 -63.99 0.88 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -123.01 162.08 23.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.712 0.768 . . . . 0.0 112.922 -177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.5 p -153.59 86.2 1.2 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.919 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -115.8 157.03 25.0 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.661 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.2 t -70.02 150.74 46.32 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.8 t -52.84 -42.87 44.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.899 0.38 . . . . 0.0 110.323 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.1 ttp-105 -58.92 -56.87 16.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.87 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.53 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.81 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.4 -44.63 94.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.119 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -68.3 -33.86 75.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 0.0 110.52 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.46 -40.83 89.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.561 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.8 mtt -65.72 -45.35 83.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.738 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.445 ' HA ' ' HG1' ' A' ' 85' ' ' THR . 64.4 mt -65.0 -36.56 84.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.615 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.48 -35.57 79.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.193 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -76.45 -20.76 56.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.383 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.445 ' HG1' ' HA ' ' A' ' 82' ' ' LEU . 56.0 p -85.85 0.69 52.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.925 0.393 . . . . 0.0 111.297 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.99 -31.74 15.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.825 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.78 168.3 11.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.625 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -66.88 110.35 3.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.024 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.9 p -121.35 173.99 7.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.849 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -82.42 -75.23 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.31 36.39 89.35 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.512 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -75.54 164.45 26.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.695 0.284 . . . . 0.0 110.662 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 23.0 m -74.65 -174.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.94 0.4 . . . . 0.0 111.636 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.524 ' HB2' ' HB3' ' A' ' 100' ' ' PHE . 1.8 p-10 -56.29 107.65 0.39 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.153 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.6 m -83.88 -1.97 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.229 -0.441 . . . . 0.0 112.175 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.767 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.2 OUTLIER -53.77 -41.5 67.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.454 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.767 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 9.4 mtmp? -88.63 -51.82 5.48 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 125.008 1.323 . . . . 0.0 111.038 -3.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -64.85 -28.57 69.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.676 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 41.4 ttmt -61.15 -41.66 97.15 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.634 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.574 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 53.3 t80 -73.84 -45.67 49.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.958 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.3 ttt -56.63 -39.03 72.94 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.759 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 mmt -74.06 -45.65 48.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.138 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.44 -40.99 79.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.755 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.2 p -72.93 -45.65 56.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.299 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.42 -46.46 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.274 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -82.83 -29.19 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.665 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.16 -16.43 79.67 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -50.08 130.86 28.62 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.603 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.598 ' H ' ' HB2' ' A' ' 110' ' ' HIS . . . -149.82 -65.94 0.01 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.788 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.598 ' HB2' ' H ' ' A' ' 109' ' ' GLY . 56.5 t-80 -138.05 -25.09 0.98 Allowed 'General case' 0 C--N 1.344 0.338 0 CA-C-N 117.828 0.814 . . . . 0.0 111.021 0.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -155.66 148.43 24.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.462 . . . . 0.0 111.639 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.493 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 86.5 m -79.11 146.49 33.18 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.0 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.41 131.63 35.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.576 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.96 142.91 46.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.297 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.509 ' HH ' ' HG3' ' A' ' 169' ' ' ARG . 36.4 m-85 -62.89 129.8 42.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.119 0.485 . . . . 0.0 110.443 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -13.3 58.1 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.197 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.65 139.91 33.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.456 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.411 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.6 127.25 32.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.26 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -111.87 159.71 11.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.606 0.717 . . . . 0.0 112.789 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.7 tp -115.39 109.18 17.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.935 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.3 mt -97.12 118.41 33.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.675 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.449 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 15.8 ttp-105 -104.24 116.59 32.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.67 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.528 ' HD1' ' HG ' ' A' ' 126' ' ' SER . 27.2 t-80 -59.78 106.75 0.52 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -51.49 -44.71 62.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -177.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 26.2 t80 -65.6 -59.17 4.23 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.528 ' HG ' ' HD1' ' A' ' 123' ' ' HIS . 59.8 p -78.2 -14.49 59.43 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 73.42 0.87 55.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.383 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -84.58 -164.79 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.441 0.162 . . . . 0.0 110.64 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.419 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.1 m-85 -134.85 138.8 44.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.5 tp -55.97 124.8 18.92 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 150' ' ' GLN . 19.3 p -134.5 147.72 50.4 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.4 t -93.76 98.52 11.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.643 -1.162 . . . . 0.0 107.891 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.1 mt -75.7 149.67 38.04 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.283 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.7 t -80.63 4.56 18.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.861 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 79.8 p -93.5 118.87 31.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.755 0.312 . . . . 0.0 111.263 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 48.4 t -66.08 -60.01 3.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.251 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 1.4 mmp_? -133.85 -37.57 0.91 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.005 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 41.3 t -162.18 78.41 0.51 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.559 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.1 t 59.05 39.04 23.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.891 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 61.8 p -132.21 -169.16 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -144.62 103.66 3.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.707 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.44 ' H ' ' HB2' ' A' ' 136' ' ' SER . 68.2 mttm -145.81 102.49 3.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.548 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.425 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 4.4 mm? 59.9 -81.45 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.653 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -100.86 153.77 19.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 112.44 -178.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.527 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 11.0 m-85 -103.32 171.62 7.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.907 177.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -91.01 144.05 26.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.72 118.53 58.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.242 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.21 -150.48 5.9 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.148 -1.025 . . . . 0.0 113.172 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 81.0 mt -116.55 143.63 45.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.051 0.453 . . . . 0.0 110.832 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.455 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 1.8 tp60 -131.74 140.82 49.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.583 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.6 -51.49 19.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.509 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.427 ' HB3' HG22 ' A' ' 154' ' ' THR . 10.0 m-20 -84.61 152.17 24.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.541 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.7 p -107.86 -3.93 18.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.731 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' THR . . . . . 0.427 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.45 117.68 3.27 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.602 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 121.93 -161.29 16.11 Favored Glycine 0 N--CA 1.441 -0.992 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.829 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -118.89 -12.21 9.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.707 0.289 . . . . 0.0 111.23 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.34 -31.87 67.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.5 m -89.6 6.85 39.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.655 0.264 . . . . 0.0 111.503 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.9 131.8 54.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.08 0.467 . . . . 0.0 111.305 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.437 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.5 m95 -127.14 115.27 18.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.711 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.489 ' HG1' ' HB ' ' A' ' 184' ' ' VAL . 10.5 p -78.13 126.24 30.52 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.152 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.4 pt -87.57 135.19 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 0.0 110.794 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 72.8 m80 -127.86 149.35 70.43 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.202 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.594 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.4 Cg_endo -65.4 136.69 47.97 Favored 'Trans proline' 0 CA--C 1.517 -0.341 0 C-N-CA 122.502 2.135 . . . . 0.0 112.323 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.08 -39.55 49.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.396 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.414 ' HG ' ' HG2' ' A' ' 168' ' ' GLN . 79.0 p -104.85 -173.12 2.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.516 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -94.11 -7.09 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.931 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.424 ' HB2' ' NH1' ' A' ' 169' ' ' ARG . 2.3 mm100 -73.78 -34.03 64.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.092 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.594 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 69.7 mmt-85 -87.97 145.13 26.16 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.829 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.1 t -127.13 167.97 15.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.459 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.23 133.58 50.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.254 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.35 -16.99 58.55 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.132 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -68.04 156.33 37.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.916 0.389 . . . . 0.0 111.103 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.27 145.47 47.87 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 91.1 t -95.11 112.38 27.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.94 0.4 . . . . 0.0 110.263 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -77.62 154.56 32.13 Favored 'General case' 0 CA--C 1.5 -0.954 0 CA-C-O 121.353 0.597 . . . . 0.0 111.595 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . 0.548 ' HB ' HE21 ' A' ' 12' ' ' GLN . 45.7 t -70.53 122.14 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.89 -13.3 32.01 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.963 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -70.16 130.13 41.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.73 0.3 . . . . 0.0 110.741 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.47 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 10.4 m-20 -73.51 115.24 12.67 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.84 149.79 23.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.818 0.818 . . . . 0.0 113.122 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.502 HD11 ' NE2' ' A' ' 209' ' ' GLN . 55.5 mt -114.26 113.17 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.84 136.87 32.86 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.175 0.512 . . . . 0.0 112.227 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.489 ' HB ' ' HG1' ' A' ' 161' ' ' THR . 84.3 t -128.77 125.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.764 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 34.5 t -65.19 123.92 20.81 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.4 t -67.44 -33.53 62.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.74 -39.54 35.92 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 65.3 m -113.35 6.94 17.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.25 32.19 0.93 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.425 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 27.6 mtt180 -114.32 141.31 47.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.918 0.39 . . . . 0.0 110.73 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.468 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.0 m-85 -72.24 153.54 41.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.25 76.8 2.37 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.407 -2.072 . . . . 0.0 105.407 175.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -76.57 151.31 36.35 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -174.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.507 HD12 ' HG ' ' A' ' 24' ' ' CYS . 13.8 tp -100.64 117.3 34.48 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.672 177.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' SER . . . . . 0.41 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 42.7 t -111.23 146.33 37.14 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.86 90.31 3.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.12 -174.53 40.77 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.464 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 71.4 m-20 -2.12 -76.62 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.42 0.688 . . . . 0.0 112.594 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 39.7 t -147.62 12.68 1.03 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.05 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.8 p -127.25 -179.86 5.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.431 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 92.1 m95 -107.22 135.92 47.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.207 0.527 . . . . 0.0 111.198 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.462 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 24.3 m-70 -127.74 173.1 10.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.108 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.86 131.98 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.104 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -149.33 172.44 14.89 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.66 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.468 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.14 94.54 6.56 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.259 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.21 174.83 5.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.129 -177.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -83.76 9.37 12.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.038 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 13.7 mm100 -115.35 136.85 52.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.534 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.502 ' NE2' HD11 ' A' ' 182' ' ' ILE . 93.8 mt-30 -66.29 175.31 2.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 122.295 1.045 . . . . 0.0 113.047 -178.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.9 m -167.98 120.82 0.88 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 113.025 -1.898 . . . . 0.0 107.891 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 37.1 mt -74.74 127.59 33.52 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.976 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.412 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.71 146.75 40.56 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.617 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.2 m -113.76 100.04 8.16 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.222 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.705 HG21 ' HG ' ' A' ' 22' ' ' LEU . 75.0 t -91.31 99.95 10.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.818 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.0 139.38 22.89 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.122 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.48 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.8 Cg_exo -63.6 106.94 0.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.018 1.812 . . . . 0.0 111.197 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.3 mm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.976 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.52 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 79.6 mm-40 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.452 ' CD1' ' HD2' ' A' ' 176' ' ' ARG . 40.5 m-85 -127.7 151.65 48.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.562 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.8 mt -81.36 123.64 28.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -111.04 156.57 21.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.939 0.399 . . . . 0.0 111.069 -179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 18' ' ' ASP . 6.8 p -67.19 155.65 38.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.844 179.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.43 -8.3 1.38 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.77 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 16' ' ' THR . 4.0 m-20 -69.05 132.27 46.35 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.913 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -79.29 123.03 27.07 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.424 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.0 m -138.23 169.78 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.659 ' HB ' ' SG ' ' A' ' 36' ' ' CYS . 2.5 m -132.74 136.19 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.335 176.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.714 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.4 mp -97.19 126.09 42.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.808 0.337 . . . . 0.0 110.918 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 44.1 mt-30 -125.14 151.06 46.26 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.488 0.661 . . . . 0.0 111.787 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -137.63 144.12 41.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.541 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.7 m -86.12 122.03 29.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.327 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.42 ' HB2' ' CE2' ' A' ' 201' ' ' TRP . . . -115.07 121.99 44.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.144 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.2 m -125.63 137.66 53.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.991 0.424 . . . . 0.0 111.616 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.0 tt -174.16 143.32 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.582 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 43.5 m80 59.64 39.34 21.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.005 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.424 ' N ' ' HE2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.4 22.6 13.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.378 179.589 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -126.67 129.09 47.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.612 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -119.61 145.85 46.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.26 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -156.74 174.3 15.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.683 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.501 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 28.0 mtmm -121.41 135.88 55.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.478 178.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 23' ' ' GLN . 1.8 mt -123.69 143.88 49.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.72 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.659 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 4.3 t -107.11 135.05 49.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.977 0.418 . . . . 0.0 110.56 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.9 tp -59.89 103.3 0.2 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.882 179.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.438 ' HB3' HD13 ' A' ' 64' ' ' ILE . . . -101.56 164.61 11.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.634 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.59 158.63 11.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.545 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -131.09 150.09 52.31 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.75 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.07 -4.25 89.99 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.918 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -109.04 161.55 15.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.891 0.377 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.69 -141.63 24.76 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.294 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.407 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.2 OUTLIER -84.38 11.86 7.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.776 0.322 . . . . 0.0 110.641 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.14 30.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.6 mt -79.59 135.83 36.69 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.7 m -76.75 150.84 36.19 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.304 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -144.89 -170.29 3.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.706 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.6 mt -127.4 143.04 51.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.313 0.578 . . . . 0.0 112.141 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.457 ' CD ' HD11 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -111.47 138.33 48.13 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.662 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.432 ' HA ' HD21 ' A' ' 35' ' ' LEU . 32.7 t -77.49 145.83 36.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.516 ' C ' ' H ' ' A' ' 54' ' ' ASN . 72.4 p -103.97 177.22 4.9 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.312 179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.487 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 14.8 m -70.0 17.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.652 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.516 ' H ' ' C ' ' A' ' 52' ' ' THR . 27.3 t-20 64.42 -88.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.591 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 58.8 m -127.06 103.19 7.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.989 -179.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 47.1 mmtm -76.47 -179.71 5.37 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 123.074 0.549 . . . . 0.0 110.917 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.678 HD21 ' H ' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -60.41 -107.37 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.796 179.769 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.678 ' H ' HD21 ' A' ' 57' ' ' ASN . 21.8 t 61.68 101.41 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.44 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 6.6 Cg_exo -75.2 141.38 26.01 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.294 2.663 . . . . 0.0 111.53 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.83 -43.41 29.37 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 C-N-CA 122.543 2.162 . . . . 0.0 111.079 179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.438 ' O ' HG12 ' A' ' 64' ' ' ILE . 11.1 t70 -119.25 91.89 3.66 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.09 178.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.578 HD11 HG13 ' A' ' 21' ' ' VAL . 43.3 tp -72.83 -29.34 63.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.292 -178.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.6 m -54.72 -40.01 68.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.457 HD11 ' CD ' ' A' ' 50' ' ' GLU . 21.0 pt -71.66 -16.86 19.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -178.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 37' ' ' LEU . 16.6 t -105.59 4.8 30.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.247 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.1 m -76.24 125.92 30.05 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.2 161.18 35.63 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.478 HG22 HH21 ' A' ' 122' ' ' ARG . 2.8 t -125.11 133.19 70.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.673 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 23.1 mt -80.7 66.19 6.13 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.7 mm-40 -45.75 -61.39 1.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -124.37 164.36 19.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.662 0.744 . . . . 0.0 112.816 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.0 t -156.43 84.51 0.98 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.829 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.1 153.23 29.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.489 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.9 p -67.27 148.61 51.49 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.9 t -50.33 -42.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.976 0.417 . . . . 0.0 110.264 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.4 ttp85 -59.67 -50.47 73.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.14 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.03 99.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.755 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.33 -46.05 88.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.182 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -66.7 -33.01 74.69 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.971 0.415 . . . . 0.0 110.583 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.35 -43.65 85.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.463 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.0 mtt -64.46 -41.81 96.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.491 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -67.4 -35.45 79.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.444 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.96 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.614 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -74.39 -22.11 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.306 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 63.9 p -84.82 1.91 44.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.948 0.404 . . . . 0.0 111.18 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 47.7 t -82.34 -35.67 13.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.004 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -114.6 154.82 27.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.88 100.02 0.38 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.5 m -155.34 127.59 7.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.007 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 62.07 -83.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.462 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.6 37.06 68.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.071 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -64.14 110.57 2.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.862 0.363 . . . . 0.0 111.104 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.03 -179.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.936 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.91 81.53 0.91 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.452 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.512 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 27.7 m -83.11 -2.39 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.024 -179.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.798 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 7.7 mm-40 -54.5 -37.79 65.73 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.798 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 51.6 mtmt -86.33 -51.59 6.15 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 120.353 1.433 . . . . 0.0 111.898 -2.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -60.51 -37.35 80.84 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.977 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.621 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 52.5 mttp -57.9 -38.03 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.276 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.718 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.1 t80 -74.04 -44.38 54.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.916 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.6 ttt -57.15 -37.95 72.82 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.431 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.3 mmt -72.36 -43.7 63.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.372 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -62.06 -34.53 76.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.585 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.4 m -72.92 -49.05 31.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.279 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.98 44.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.391 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -70.07 -49.7 48.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.291 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.66 -58.58 13.13 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.618 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 62.79 -128.3 40.25 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.02 -82.77 0.81 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.558 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -95.43 -171.67 2.45 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.83 0.815 . . . . 0.0 110.736 -0.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -151.45 140.8 21.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.276 0.56 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 92.2 m -75.47 146.0 40.99 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.139 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.33 134.33 36.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.1 mt -117.64 142.06 47.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.864 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -61.67 127.96 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.67 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.45 -9.43 55.83 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.968 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -85.39 139.42 31.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 111.079 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.26 127.14 32.38 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.8 pt -112.12 157.7 12.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.587 0.708 . . . . 0.0 112.854 -178.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.7 tp -113.26 109.08 18.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.936 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.1 mt -97.06 117.71 31.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.489 HH11 ' HA2' ' A' ' 127' ' ' GLY . 60.2 ttp85 -104.22 117.79 35.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.689 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.476 ' HD1' ' H ' ' A' ' 126' ' ' SER . 30.4 t-80 -60.02 105.45 0.4 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 177.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 45.7 t -46.5 -53.91 10.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -58.12 -71.48 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.476 ' H ' ' HD1' ' A' ' 123' ' ' HIS . 77.9 p -62.21 -25.05 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . 0.489 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 81.87 -0.82 87.93 Favored Glycine 0 C--N 1.322 -0.234 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.288 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 45.9 mtt -83.03 -164.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.489 0.185 . . . . 0.0 110.673 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.451 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.0 m-85 -135.61 139.28 43.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.56 126.1 23.86 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.7 t -136.06 147.97 48.12 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.8 t -94.42 99.07 11.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.8 mt -77.37 146.0 36.93 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.624 -178.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -0.12 17.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.932 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.2 p -88.87 121.6 31.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.72 0.295 . . . . 0.0 110.974 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 42.0 t -71.63 -61.16 1.88 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.712 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -178.39 109.83 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.768 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.5 m 60.24 -85.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.4 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 52.5 m -152.07 -0.71 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.4 p -118.79 -172.26 2.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.329 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 63.69 158.46 0.08 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.229 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -155.35 -11.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.25 -66.21 0.52 Allowed 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 111.128 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -108.31 151.68 25.65 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.573 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 10.5 m-85 -99.49 170.49 8.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.141 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -90.15 143.14 27.04 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.86 116.76 53.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.275 178.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.05 -151.85 6.56 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.881 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.515 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 68.7 mt -113.89 147.0 39.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.81 0.338 . . . . 0.0 110.561 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -136.69 140.79 42.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.099 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -74.16 -47.94 32.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.594 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -84.99 146.89 26.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.1 p -107.98 -10.26 15.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.99 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.1 p -54.52 112.37 0.99 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.355 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 131.87 -158.44 22.86 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.341 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.461 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.2 mt-10 -121.8 -14.43 8.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.717 0.294 . . . . 0.0 111.24 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . 0.4 ' N ' ' HB2' ' A' ' 187' ' ' SER . . . -57.61 -32.79 67.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.174 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.3 m -89.45 5.97 42.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.604 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -110.19 132.56 54.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.111 0.481 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.427 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.47 117.18 21.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.649 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.425 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 7.7 p -79.13 128.01 32.75 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.133 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.26 134.33 28.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.455 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 69.8 m80 -127.96 151.85 76.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.291 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.611 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.6 Cg_endo -68.78 137.45 38.47 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.504 2.136 . . . . 0.0 112.291 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.45 -40.41 43.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.438 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.1 p -105.52 -171.12 1.85 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.499 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -95.51 -0.94 51.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.0 -36.06 49.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.989 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.611 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.2 mmp_? -87.57 149.45 24.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.525 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 47.7 t -131.75 161.74 32.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.017 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.27 126.75 29.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.137 179.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.61 -14.91 57.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.688 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.79 156.57 38.77 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -72.93 136.85 45.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.372 178.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.426 HG21 HD11 ' A' ' 162' ' ' ILE . 84.3 t -85.57 119.29 33.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.378 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 11.0 mmm180 -84.6 153.99 22.86 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-O 121.364 0.602 . . . . 0.0 111.513 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 40.9 t -69.66 122.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.28 -8.3 38.05 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.295 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -73.09 131.44 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.742 0.306 . . . . 0.0 110.9 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.488 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 24.5 m-20 -72.57 110.97 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 69.0 mt -97.51 149.68 21.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . 0.498 HD13 ' NE2' ' A' ' 209' ' ' GLN . 54.4 mt -114.41 113.17 42.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.13 138.6 31.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.101 0.477 . . . . 0.0 112.069 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.425 ' HB ' ' OG1' ' A' ' 161' ' ' THR . 75.5 t -130.21 123.66 56.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.81 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' SER . . . . . 0.557 ' HG ' ' HB2' ' A' ' 188' ' ' SER . 87.5 p -65.23 119.15 10.37 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.461 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.1 t -63.17 -31.86 54.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.19 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' SER . . . . . 0.4 ' HB2' ' N ' ' A' ' 157' ' ' ALA . 44.2 t -77.49 -39.2 47.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -178.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.557 ' HB2' ' HG ' ' A' ' 185' ' ' SER . 54.7 m -116.66 9.89 14.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -177.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 185' ' ' SER . 0.4 OUTLIER 44.38 32.93 0.78 Allowed 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.584 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.469 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 29.0 mtt180 -113.31 140.27 48.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.95 0.405 . . . . 0.0 110.815 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' ' 183' ' ' LEU . 54.4 m-85 -72.17 153.62 41.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 31.1 tp -74.82 76.54 2.11 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 175.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -75.98 150.03 37.51 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -174.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.3 tp -100.14 116.53 32.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.602 177.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' SER . . . . . 0.402 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 49.2 p -110.1 145.39 37.22 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -105.82 91.05 3.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.15 178.83 53.43 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.032 179.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.517 ' C ' ' O ' ' A' ' 197' ' ' GLY . 54.5 m-20 9.55 -82.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.326 0.651 . . . . 0.0 112.51 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 47.5 t -143.08 4.11 1.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.527 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.4 p -119.89 -179.35 3.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.195 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 26' ' ' ALA . 93.3 m95 -105.83 139.12 40.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.249 0.547 . . . . 0.0 111.341 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.431 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 32.7 m-70 -130.41 172.5 11.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.073 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.26 133.89 67.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.223 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -151.96 170.96 18.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.662 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.469 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -97.61 96.53 8.35 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.97 174.8 5.84 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.113 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -83.57 11.11 7.6 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.051 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -117.63 135.76 53.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.441 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . 0.498 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.0 mt-30 -65.56 175.23 1.89 Allowed 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 122.31 1.052 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.4 m -168.62 120.82 0.8 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.084 -1.871 . . . . 0.0 107.836 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.488 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 27.9 mt -74.88 129.11 37.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.077 0.465 . . . . 0.0 109.85 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.419 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.0 m95 -116.06 146.74 41.95 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.632 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 45.7 t -113.7 101.77 9.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.133 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.714 HG23 ' HG ' ' A' ' 22' ' ' LEU . 79.3 t -92.88 101.78 12.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.779 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.84 140.3 23.87 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.2 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.412 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.0 Cg_exo -63.74 104.03 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 121.975 1.783 . . . . 0.0 110.984 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.438 HD12 ' HA ' ' A' ' 217' ' ' ILE . 3.8 mm . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.383 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.457 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 14.9 mm100 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.706 0.288 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -119.37 154.64 33.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.694 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.0 mt -82.51 121.67 27.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.26 157.16 19.1 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.012 0.434 . . . . 0.0 111.086 -179.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.443 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.6 p -68.27 156.63 37.28 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.45 -8.94 1.11 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.701 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 16' ' ' THR . 4.8 m-20 -67.91 135.35 52.33 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -82.0 118.05 22.69 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.2 m -134.83 172.62 15.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.653 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -134.91 139.31 47.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.2 176.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.698 ' HG ' HG21 ' A' ' 214' ' ' VAL . 7.5 mp -100.0 120.93 40.59 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.689 0.281 . . . . 0.0 110.662 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.442 HE22 ' HZ1' ' A' ' 34' ' ' LYS . 24.2 mt-30 -118.19 160.19 22.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.438 0.637 . . . . 0.0 111.793 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -146.76 143.61 28.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.319 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -88.04 121.59 30.63 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.054 0.454 . . . . 0.0 110.405 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.441 ' HB2' HD13 ' A' ' 35' ' ' LEU . . . -113.0 121.72 45.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.978 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 m -126.22 130.09 50.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.986 0.422 . . . . 0.0 111.86 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.8 tt -168.74 149.23 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.51 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 44.0 m80 59.28 39.32 22.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.11 23.67 13.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -127.77 147.17 50.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.455 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -131.75 148.78 52.6 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.967 0.413 . . . . 0.0 111.028 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.435 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -161.67 165.28 28.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.672 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HE3' ' HB3' ' A' ' 57' ' ' ASN . 37.9 mtmt -113.32 135.22 54.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.428 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.441 HD13 ' HB2' ' A' ' 26' ' ' ALA . 2.3 mt -124.69 142.33 51.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.728 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.585 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 47.6 t -106.36 145.58 31.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.4 . . . . 0.0 110.588 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.471 ' HA ' HD21 ' A' ' 49' ' ' LEU . 33.4 tp -65.32 114.59 4.87 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.585 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 64' ' ' ILE . . . -113.8 164.61 13.52 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.417 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 161.1 10.4 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.594 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.67 144.17 51.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.724 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.448 ' HA2' ' HE1' ' A' ' 128' ' ' MET . . . -76.8 -9.23 86.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.775 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -106.01 162.87 13.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 111.146 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.97 -142.5 26.52 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.477 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 19.6 p30 -83.02 9.71 9.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.747 0.308 . . . . 0.0 110.833 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.47 29.29 0.38 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.177 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.2 mt -79.44 137.59 37.3 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.938 0.399 . . . . 0.0 110.487 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.4 m -77.91 153.89 32.17 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.634 0.73 . . . . 0.0 111.524 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -148.34 -166.11 2.45 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.319 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.471 HD21 ' HA ' ' A' ' 37' ' ' LEU . 25.5 mt -130.44 143.89 51.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.299 0.571 . . . . 0.0 112.429 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 mt-10 -111.26 141.46 44.76 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.594 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.434 ' HA ' HD22 ' A' ' 35' ' ' LEU . 48.0 t -81.94 142.39 32.48 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.493 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 51.5 p -104.67 166.65 10.25 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.561 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 17.7 m -53.69 -21.17 6.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.464 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.9 t30 64.25 113.3 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.68 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.438 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 80.8 p 46.87 74.92 0.13 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.774 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.462 ' HE2' HG21 ' A' ' 58' ' ' VAL . 23.2 pttm -83.86 169.14 15.43 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 122.841 0.457 . . . . 0.0 110.481 -0.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.51 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 6.6 p-10 -58.16 -102.82 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.116 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.472 ' H ' ' CG ' ' A' ' 57' ' ' ASN . 32.9 t 60.82 100.04 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -74.99 140.37 25.39 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.393 2.729 . . . . 0.0 111.451 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.411 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.6 Cg_endo -51.24 -38.86 62.34 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.392 2.061 . . . . 0.0 111.459 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -120.59 81.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.676 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.573 HD11 HG13 ' A' ' 21' ' ' VAL . 45.2 tp -63.01 -30.33 71.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.541 -178.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.2 p -45.26 -56.63 4.66 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.468 HD11 ' HB3' ' A' ' 38' ' ' ALA . 30.4 pt -67.98 -18.24 23.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.653 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.59 -3.29 46.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.917 0.389 . . . . 0.0 111.679 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.0 m -83.66 134.74 34.77 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -138.82 163.62 31.77 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' ' 124' ' ' SER . 6.0 t -127.61 133.83 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.774 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.5 mt -82.45 65.33 7.53 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.459 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 11.8 mm-40 -45.22 -66.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.438 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 20.0 mm-40 -119.25 166.61 12.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.743 0.783 . . . . 0.0 113.1 -177.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.4 t -159.62 82.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.402 -1.272 . . . . 0.0 108.746 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.9 mt -111.6 157.11 20.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.388 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 t -69.13 150.04 47.99 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 41.3 t -52.88 -42.94 44.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.06 0.457 . . . . 0.0 110.18 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -59.24 -51.74 68.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.25 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -63.62 -41.15 98.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.721 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.81 -44.32 96.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.001 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -68.29 -34.03 75.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.911 0.386 . . . . 0.0 110.645 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -66.66 -41.57 87.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.704 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.3 mtt -64.31 -44.89 90.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.668 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' O ' HG21 ' A' ' 86' ' ' VAL . 82.2 mt -66.58 -34.76 78.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.16 75.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.049 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -74.4 -19.46 60.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.681 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.5 p -85.88 -12.11 51.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.764 0.316 . . . . 0.0 111.466 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 82' ' ' LEU . 20.4 t -78.03 -37.18 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.906 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -120.24 179.94 4.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -60.31 149.52 33.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.81 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.5 t -83.14 154.43 24.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.994 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -90.2 98.1 11.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.87 -12.61 8.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.473 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 59.9 101.4 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.832 0.349 . . . . 0.0 111.183 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 m -61.01 -40.43 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.288 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -94.28 85.27 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.366 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.7 t -84.23 -11.08 11.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.915 0.388 . . . . 0.0 111.516 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.705 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 15.3 mm-40 -53.79 -44.17 69.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.644 -0.694 . . . . 0.0 112.74 -179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.705 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 46.9 mtmt -86.27 -49.81 7.42 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 0.0 110.881 -2.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.422 ' O ' ' HG2' ' A' ' 102' ' ' MET . 49.0 t90 -53.97 -43.66 70.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.651 -178.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.608 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -58.37 -30.3 66.68 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.153 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.68 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 9.8 t80 -73.87 -47.52 37.59 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.523 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 14.9 tpt -56.71 -38.62 72.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.603 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.422 ' HG2' ' O ' ' A' ' 98' ' ' TRP . 91.2 mmm -72.74 -43.37 63.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -57.45 -40.01 77.53 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.474 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 74.1 p -72.45 -46.83 53.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.97 -26.61 67.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -90.26 -32.07 16.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.894 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.62 -49.16 52.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.668 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -66.09 176.19 17.7 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.804 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.611 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . -69.12 -173.79 9.54 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-O 119.413 -0.659 . . . . 0.0 112.618 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.611 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 45.5 m80 59.04 25.64 14.13 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.959 1.38 . . . . 0.0 111.93 -0.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -84.34 146.41 27.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.124 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.7 m -75.8 146.7 39.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.287 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.2 131.68 35.31 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.768 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -116.04 141.98 47.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.244 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.58 129.13 39.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.451 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.16 -13.43 57.24 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.951 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.37 141.93 32.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.053 0.454 . . . . 0.0 111.303 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.74 125.22 31.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.3 pt -110.31 160.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.487 HD21 HG21 ' A' ' 153' ' ' THR . 20.0 tp -116.84 111.62 19.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.036 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 52.7 mt -98.82 117.69 33.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.495 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.454 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 17.2 ttp-105 -103.24 115.53 30.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.763 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.9 t-80 -58.18 108.19 0.57 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.428 ' HG ' HG21 ' A' ' 68' ' ' VAL . 44.0 m -52.82 -46.27 67.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.489 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 60.4 t80 -63.33 -59.28 4.92 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.468 ' HB3' ' HD1' ' A' ' 123' ' ' HIS . 45.2 t -78.27 -17.0 57.24 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.67 -2.33 59.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.552 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.448 ' HE1' ' HA2' ' A' ' 41' ' ' GLY . 62.3 mtm -84.13 -167.11 1.63 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.459 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 63.5 m-85 -130.93 139.0 50.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.436 HD12 HD21 ' A' ' 37' ' ' LEU . 30.3 tp -54.87 128.69 34.32 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 46.2 t -137.72 147.78 45.07 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.5 t -95.07 98.38 10.62 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.491 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.8 mt -75.33 153.43 37.86 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.618 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.0 t -80.66 -4.59 54.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.769 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 32.4 p -83.95 122.01 28.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.728 0.299 . . . . 0.0 111.131 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 50.8 m -69.28 -60.52 2.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -173.9 -57.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 52.6 m -134.31 -78.66 0.46 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.882 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.7 t -178.64 13.02 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 75.9 p -118.91 -11.78 9.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.46 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.24 150.71 37.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.246 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -143.39 -3.98 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.684 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.63 -66.48 0.51 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -109.35 154.4 22.59 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.641 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.491 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 15.6 m-85 -101.61 172.22 7.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.143 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -90.52 145.13 25.13 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 92.7 t -115.2 117.39 55.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.307 178.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.39 -149.58 5.84 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.87 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.0 mt -114.63 150.03 35.73 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.852 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' A' ' 133' ' ' LEU . 2.4 tp-100 -137.4 139.34 40.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.775 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -68.63 -68.43 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.543 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -74.97 154.35 38.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.712 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.487 HG21 HD21 ' A' ' 120' ' ' LEU . 81.4 p -106.3 3.96 28.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.013 0.435 . . . . 0.0 111.096 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 74.9 p -59.15 114.12 2.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.312 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.35 -164.39 18.94 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.656 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.8 mt-10 -116.27 -13.8 11.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.676 0.274 . . . . 0.0 111.306 -179.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.34 65.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.198 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 30.0 p -88.83 6.67 37.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.632 0.253 . . . . 0.0 111.674 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -110.4 133.53 53.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.153 0.501 . . . . 0.0 111.347 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.422 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.3 m95 -127.78 115.96 19.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.623 -179.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.4 p -78.12 123.33 26.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.049 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.0 pt -85.89 136.93 21.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.99 0.424 . . . . 0.0 110.982 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -128.75 149.84 73.24 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.034 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.609 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 38.5 Cg_endo -66.71 137.79 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.449 2.1 . . . . 0.0 112.38 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.61 -42.47 51.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -107.92 -169.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -91.64 -8.59 46.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.066 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -67.98 -38.31 82.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.047 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.609 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.6 mmp_? -88.59 150.84 22.85 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.824 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 60.4 m -133.28 167.83 19.67 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.881 0.372 . . . . 0.0 111.011 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.53 127.94 34.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.528 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.27 -14.72 63.28 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.086 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.53 155.98 40.01 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.031 0.443 . . . . 0.0 111.313 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 43.9 mttp -72.56 141.48 48.45 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.4 HG12 HD22 ' A' ' 181' ' ' LEU . 86.1 t -91.11 120.92 40.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 18.8 mmt180 -84.8 153.81 22.74 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-O 121.156 0.503 . . . . 0.0 111.381 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.11 122.22 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.39 -14.77 35.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.399 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.33 127.13 31.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.947 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.548 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.9 m-20 -68.52 110.06 4.02 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.438 HD11 HG22 ' A' ' 214' ' ' VAL . 69.4 mt -96.36 149.23 21.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.79 0.805 . . . . 0.0 112.924 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.06 112.51 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.9 mp -92.96 135.64 33.97 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.14 -178.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . . . . . . . . . 84.9 t -127.75 127.75 68.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.75 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -64.43 127.86 33.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -71.22 -31.82 45.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.698 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.0 t -80.08 -36.65 35.22 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.507 ' HG ' ' HB2' ' A' ' 190' ' ' ARG . 60.4 p -116.74 2.4 12.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 50.42 28.31 3.24 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 179.772 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.507 ' HB2' ' HG ' ' A' ' 188' ' ' SER . 26.0 mtt180 -108.89 140.76 41.92 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.937 0.399 . . . . 0.0 110.99 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.3 m-85 -72.03 153.77 41.55 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.42 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 28.5 tp -75.31 76.72 2.41 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 105.253 -2.129 . . . . 0.0 105.253 175.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -76.82 149.66 36.18 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 115.454 1.649 . . . . 0.0 115.454 -174.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.452 ' H ' ' HG1' ' A' ' 210' ' ' THR . 12.1 tp -99.0 115.02 27.97 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 113.78 -1.554 . . . . 0.0 107.622 177.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.0 t -107.83 146.54 32.11 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -177.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -106.0 91.89 3.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.49 -175.07 47.05 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.36 -0.924 . . . . 0.0 111.507 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 79.6 m-20 -0.25 -78.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.379 0.671 . . . . 0.0 112.386 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 79.3 p -146.2 12.65 1.23 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.095 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 77.0 p -126.57 -178.54 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.868 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.411 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 93.6 m95 -107.81 136.3 47.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.223 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.472 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 21.4 m-70 -129.15 173.27 10.63 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.949 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.45 131.27 71.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.204 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -147.72 170.19 18.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.544 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.463 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.61 94.19 6.84 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -112.79 176.5 4.99 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.09 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.32 7.96 20.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.1 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -114.43 136.37 53.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.733 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.81 174.52 1.82 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.45 1.119 . . . . 0.0 113.119 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.452 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 24.8 m -168.61 119.86 0.78 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 112.886 -1.961 . . . . 0.0 107.72 178.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 48.7 mt -73.68 129.8 38.69 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.956 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.435 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -116.89 138.5 51.49 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.738 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.7 m -105.44 100.65 10.22 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.711 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.698 HG21 ' HG ' ' A' ' 22' ' ' LEU . 87.4 t -91.96 101.58 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.777 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.89 142.32 28.22 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.196 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.76 104.97 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.18 1.92 . . . . 0.0 111.116 178.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.449 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.5 mm . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.24 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.507 ' H ' HH11 ' A' ' 176' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 121.017 0.437 . . . . 0.0 111.365 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -116.66 156.07 27.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.545 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.3 mt -81.04 122.72 27.66 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -110.0 156.83 19.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.063 0.459 . . . . 0.0 111.093 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.441 ' HG1' ' H ' ' A' ' 111' ' ' ARG . 10.5 p -68.2 155.33 39.88 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.753 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 71.97 -4.03 2.06 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.753 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.417 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.46 134.43 45.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.623 179.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -81.26 120.98 25.59 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.414 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.84 171.61 15.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -177.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.507 HG11 HD13 ' A' ' 62' ' ' LEU . 3.2 m -132.82 137.4 54.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.349 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.707 ' HG ' HG23 ' A' ' 214' ' ' VAL . 7.6 mp -98.11 124.87 42.86 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.472 ' OE1' ' HB2' ' A' ' 57' ' ' ASN . 21.6 mt-30 -125.64 143.32 51.08 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.439 0.638 . . . . 0.0 112.339 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -128.89 144.08 51.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.851 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -86.61 120.58 28.08 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.134 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.44 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.19 121.25 44.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.258 -179.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 m -124.5 137.63 54.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.622 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.8 tt -177.64 146.16 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.581 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 47.8 m80 58.97 40.12 22.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.183 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 60.64 22.03 11.9 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.283 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -126.46 138.4 53.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.452 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -126.65 147.63 49.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.974 0.416 . . . . 0.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -159.39 172.84 17.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.564 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -120.47 140.42 51.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.45 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -128.97 143.57 50.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.424 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.9 p -106.96 138.33 43.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.014 0.435 . . . . 0.0 110.722 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.529 ' HA ' HD22 ' A' ' 49' ' ' LEU . 29.5 tp -60.08 111.04 1.36 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.091 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.414 ' HB1' HD13 ' A' ' 64' ' ' ILE . . . -111.39 165.68 11.76 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.599 -179.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.87 163.36 13.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.811 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -134.67 145.35 48.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.522 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.92 12.18 58.18 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.782 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -121.14 151.39 39.96 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.926 0.393 . . . . 0.0 110.808 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.9 -137.34 18.52 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.425 ' C ' HD21 ' A' ' 44' ' ' ASN . 0.3 OUTLIER -83.31 8.99 11.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.789 0.328 . . . . 0.0 110.893 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.487 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.28 31.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.099 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.415 ' H ' HD21 ' A' ' 44' ' ' ASN . 39.5 mt -78.52 135.06 37.24 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 110.509 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.3 m -75.66 150.52 37.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.56 0.695 . . . . 0.0 111.297 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -144.03 -167.13 2.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 108.594 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.529 HD22 ' HA ' ' A' ' 37' ' ' LEU . 29.8 mt -131.87 142.82 49.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.7 mt-10 -107.23 136.64 46.72 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.794 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.455 ' HA ' HD22 ' A' ' 35' ' ' LEU . 76.7 p -79.84 134.01 36.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.526 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 69.5 p -102.66 150.33 23.54 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.727 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.3 m -65.44 -7.51 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.545 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 65.64 130.65 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.741 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.65 ' N ' ' H ' ' A' ' 57' ' ' ASN . 38.0 t 57.96 85.2 0.09 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 41.0 ttmt -100.39 78.96 2.07 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.252 0.621 . . . . 0.0 111.146 -0.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.65 ' H ' ' N ' ' A' ' 55' ' ' SER . 3.8 p-10 39.12 36.44 0.18 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.073 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.92 106.63 0.98 Allowed Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 4.6 Cg_exo -79.99 140.46 14.29 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.784 2.323 . . . . 0.0 110.918 177.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -46.8 -40.16 24.59 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.543 2.162 . . . . 0.0 111.467 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -130.93 92.34 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.592 179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.507 HD13 HG11 ' A' ' 21' ' ' VAL . 48.3 tp -68.37 -29.14 67.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.031 -178.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.2 m -53.14 -48.74 67.68 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.414 HD13 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -68.27 -17.68 22.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 61.2 m -99.92 13.75 32.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -92.01 130.97 37.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.567 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.7 159.12 42.84 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.259 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.503 HG23 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -123.51 133.68 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.606 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.404 HD11 ' HB2' ' A' ' 18' ' ' ASP . 18.9 mt -81.72 64.77 6.57 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 9.5 mm-40 -44.13 -61.28 1.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -178.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -125.21 165.4 18.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.706 0.765 . . . . 0.0 112.889 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -157.82 85.67 0.9 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.935 179.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -113.84 159.22 20.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.469 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.42 ' HB2' HH12 ' A' ' 76' ' ' ARG . 9.4 m -70.25 149.13 47.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.4 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 56.1 t -52.0 -45.05 40.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.004 0.43 . . . . 0.0 110.219 179.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.42 HH12 ' HB2' ' A' ' 74' ' ' SER . 1.9 tmm_? -57.37 -54.55 45.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.26 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -58.75 -44.96 90.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.909 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.6 tp -60.67 -47.17 87.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.444 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 96.3 mt-30 -65.67 -34.61 78.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.868 0.365 . . . . 0.0 110.669 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -66.27 -40.9 90.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.854 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.456 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.1 mtt -63.86 -45.77 87.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.861 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.59 -34.37 76.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.874 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.26 -34.04 75.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.952 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -69.51 -26.5 64.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.361 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 p -78.62 -12.89 60.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.742 0.306 . . . . 0.0 111.219 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 t -75.05 -51.12 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.042 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -99.61 120.62 39.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.813 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -96.37 135.36 38.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 77.0 p -161.52 178.38 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.765 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -75.75 147.66 39.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 106.61 -22.45 30.4 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.749 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 57.25 -168.68 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.71 0.29 . . . . 0.0 110.802 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.57 -37.11 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.912 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -85.47 77.34 9.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.001 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.478 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 35.6 m -82.45 2.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.883 -178.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.793 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 2.2 mm-40 -53.76 -38.22 64.19 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.791 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.793 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 56.2 mtpt -87.43 -51.85 5.7 Favored 'General case' 0 C--N 1.353 0.75 0 CA-C-N 120.324 1.42 . . . . 0.0 111.592 -3.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -66.31 -28.48 68.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.918 -1.492 . . . . 0.0 113.031 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.625 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.2 mptm? -60.29 -45.88 91.79 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.876 -0.729 . . . . 0.0 110.132 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . 0.589 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 22.6 t80 -74.14 -41.95 60.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.261 179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -56.83 -46.35 81.75 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.982 0.42 . . . . 0.0 110.557 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.1 tmm? -71.04 -41.98 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.736 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -57.47 -40.39 78.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.745 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 49.2 p -73.05 -52.71 13.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.273 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.71 -27.45 62.97 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.459 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -85.52 -52.73 5.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.741 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.44 -62.02 6.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.532 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 53.65 -100.25 0.06 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.607 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -157.27 -170.76 22.52 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.336 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -84.61 -164.63 1.0 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 117.631 0.716 . . . . 0.0 110.819 -0.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.441 ' H ' ' HG1' ' A' ' 16' ' ' THR . 16.6 ptp180 -157.89 147.01 19.55 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.144 0.497 . . . . 0.0 111.5 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 98.0 m -79.56 146.74 32.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.16 131.92 35.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.826 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.28 141.98 47.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.041 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -62.32 126.07 26.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.093 0.473 . . . . 0.0 110.59 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.48 -11.34 50.61 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.053 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 141.26 31.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.06 126.97 32.61 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.2 pt -112.05 160.27 11.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.564 0.697 . . . . 0.0 112.777 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.453 HD22 HG22 ' A' ' 153' ' ' THR . 20.3 tp -115.78 110.38 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.053 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 61.9 mt -98.4 116.51 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.641 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.503 ' NH2' HG23 ' A' ' 68' ' ' VAL . 56.1 ttp85 -102.81 116.38 32.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.62 179.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.461 ' HD1' ' CB ' ' A' ' 126' ' ' SER . 24.7 t-80 -59.37 106.54 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 177.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.2 t -50.72 -45.65 58.64 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 37.5 t80 -65.27 -59.55 3.94 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.461 ' CB ' ' HD1' ' A' ' 123' ' ' HIS . 11.4 m -75.76 -16.42 60.13 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -3.35 48.49 Favored Glycine 0 N--CA 1.454 -0.159 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.379 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 61.9 mtm -84.76 -166.25 1.42 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.483 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.1 m-85 -131.67 140.53 49.36 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -177.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.8 tp -55.23 129.55 38.75 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.0 t -138.69 149.26 44.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.1 t -96.4 95.98 8.41 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 176.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.522 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.4 mt -71.85 154.53 41.2 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.412 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.2 m -83.96 3.58 33.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.048 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.1 p -90.8 127.19 36.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.717 0.294 . . . . 0.0 111.018 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.0 p -67.53 -60.36 2.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.846 0.355 . . . . 0.0 110.75 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -172.2 -78.08 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 56.6 p -127.25 -67.82 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.037 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -167.78 16.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.845 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 63.1 m -58.4 -77.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.145 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -160.18 -81.3 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.98 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -170.73 -92.96 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.203 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 143' ' ' LEU . 2.2 mm? 55.95 -85.73 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.436 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -107.31 150.7 26.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.154 0.502 . . . . 0.0 111.361 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 12.4 m-85 -98.12 167.2 11.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.264 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -87.05 145.51 26.44 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.041 0.448 . . . . 0.0 109.96 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 89.7 t -115.06 116.56 52.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.51 -151.62 6.25 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.705 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.487 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.5 mt -112.67 148.55 34.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.949 0.404 . . . . 0.0 110.737 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.19 40.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.87 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.5 -77.87 0.06 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.674 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.05 153.06 44.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.453 HG22 HD22 ' A' ' 120' ' ' LEU . 73.2 p -104.3 4.02 33.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.099 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.4 p -56.2 115.46 2.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.67 -162.29 16.53 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.636 -0.792 . . . . 0.0 111.741 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.52 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.1 mt-10 -118.97 -9.96 9.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.707 0.289 . . . . 0.0 111.39 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.93 -31.13 68.39 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -91.18 8.1 37.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.583 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.6 133.09 54.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.458 . . . . 0.0 111.183 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' TRP . . . . . 0.444 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.8 m95 -128.57 117.41 21.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.779 -178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' THR . . . . . 0.426 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 10.7 p -79.2 125.99 30.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.136 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.2 pt -87.69 136.41 23.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.928 0.394 . . . . 0.0 110.938 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -128.6 150.94 76.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.087 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.647 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.0 Cg_endo -67.84 140.92 52.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.488 2.125 . . . . 0.0 112.286 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.87 -46.22 54.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.809 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.426 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 58.9 m -112.92 -171.09 1.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.44 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' LYS . . . . . 0.479 ' HG3' ' NE2' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -88.51 8.27 28.9 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.235 -179.624 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.479 ' NE2' ' HG3' ' A' ' 167' ' ' LYS . 8.7 mm-40 -81.36 -37.8 27.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.059 0.457 . . . . 0.0 110.567 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.647 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 78.4 mmt-85 -91.82 150.46 21.06 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.402 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.469 ' HG ' ' H ' ' A' ' 171' ' ' GLU . 44.9 t -128.46 166.53 18.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.136 -179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.469 ' H ' ' HG ' ' A' ' 170' ' ' SER . 0.8 OUTLIER -67.99 128.54 36.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.309 179.55 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 98.3 -16.39 60.03 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.877 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -69.1 156.38 38.77 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.929 0.395 . . . . 0.0 111.201 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -72.95 143.48 47.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . 0.405 HG13 HD23 ' A' ' 181' ' ' LEU . 93.0 t -93.43 118.89 40.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.458 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ARG . . . . . 0.507 HH11 ' H ' ' A' ' 12' ' ' GLN . 26.8 mmt180 -83.39 155.34 23.54 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.322 0.582 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' VAL . . . . . 0.417 ' HB ' ' NE2' ' A' ' 12' ' ' GLN . 30.7 t -69.46 120.95 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -15.13 33.19 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.379 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -65.68 128.76 37.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.697 0.284 . . . . 0.0 110.732 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 3.9 m-20 -69.76 111.17 5.34 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' LEU . . . . . 0.405 HD23 HG13 ' A' ' 175' ' ' VAL . 76.8 mt -97.27 148.73 22.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.65 112.02 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' LEU . . . . . 0.468 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -91.89 138.24 31.71 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.141 0.496 . . . . 0.0 112.108 -178.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' VAL . . . . . 0.427 HG21 ' CD1' ' A' ' 191' ' ' TYR . 88.9 t -129.15 128.21 66.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.797 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -65.48 127.36 31.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.52 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 87.8 t -71.93 -33.35 47.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.637 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.7 p -80.42 -36.02 34.29 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 63.2 m -114.83 2.41 14.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 49.31 29.02 2.53 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.3 mtt180 -111.63 140.19 46.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 110.87 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' TYR . . . . . 0.472 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.0 m-85 -71.11 155.12 41.14 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.7 tp -75.52 75.83 2.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' HIS . . . . . 0.449 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.4 t60 -75.46 150.09 38.33 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -174.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' LEU . . . . . 0.406 ' H ' ' HG1' ' A' ' 210' ' ' THR . 13.5 tp -100.21 112.6 24.93 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 113.649 -1.614 . . . . 0.0 107.639 177.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 62.9 p -105.0 145.69 30.08 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.23 91.36 3.76 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' GLY . . . . . 0.532 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.69 -174.49 44.6 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.511 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 11.9 m-80 -0.42 -78.92 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.302 0.641 . . . . 0.0 112.366 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 50.4 m -146.93 13.19 1.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.927 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.8 p -126.61 -177.81 4.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.917 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' TRP . . . . . 0.44 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.6 m95 -108.56 135.09 50.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.314 0.578 . . . . 0.0 111.341 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' HIS . . . . . 0.502 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.4 m-70 -128.33 174.11 9.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.4 p -126.78 132.14 70.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 52.0 p-10 -150.09 167.11 27.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.715 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.32 95.27 8.79 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.32 173.64 6.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.339 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -81.55 8.01 10.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' GLN . . . . . 0.449 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 74.9 mm-40 -114.67 137.42 51.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.731 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -66.13 174.82 2.36 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 122.279 1.038 . . . . 0.0 112.809 -178.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 210' ' ' THR . . . . . 0.406 ' HG1' ' H ' ' A' ' 194' ' ' LEU . 27.0 m -168.01 121.02 0.89 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.186 -1.824 . . . . 0.0 107.945 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 211' ' ' LEU . . . . . 0.436 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 68.4 mt -75.37 128.06 34.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.98 0.419 . . . . 0.0 109.967 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.64 145.77 42.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.9 m -114.01 102.36 10.11 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.206 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 214' ' ' VAL . . . . . 0.707 HG23 ' HG ' ' A' ' 22' ' ' LEU . 80.4 t -93.39 105.55 16.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.041 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -116.69 141.4 28.07 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.247 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 216' ' ' PRO . . . . . 0.472 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.5 Cg_exo -64.31 104.73 0.53 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.194 1.929 . . . . 0.0 111.192 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 217' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 216' ' ' PRO . 1.7 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.986 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.429 ' HB3' HG23 ' A' ' 112' ' ' THR . 44.4 m-85 . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.958 0.408 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.79 126.09 30.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.435 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 10.5 mmm180 -112.83 156.59 22.63 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.096 0.475 . . . . 0.0 111.226 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 p -67.46 156.09 37.44 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.801 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 70.92 -2.84 2.18 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.856 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.1 m-20 -73.25 133.82 44.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.6 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -80.8 120.49 24.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -136.42 171.98 16.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.568 HG11 HD11 ' A' ' 62' ' ' LEU . 3.3 m -133.09 135.79 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 114.682 -1.145 . . . . 0.0 108.239 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -96.85 123.65 40.61 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.563 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 69.9 mt-30 -120.42 163.05 18.48 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.4 0.619 . . . . 0.0 111.359 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -150.96 139.43 20.48 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.422 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -83.81 121.41 27.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.513 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.612 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.67 119.09 35.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.968 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.4 m -122.91 136.9 55.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.002 0.43 . . . . 0.0 111.695 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.6 tt -171.49 145.32 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.3 m80 59.29 37.84 23.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.42 22.52 13.29 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.503 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.62 131.93 49.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.405 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -118.81 144.42 46.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.025 0.44 . . . . 0.0 111.41 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -154.03 171.93 18.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.631 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -119.41 141.14 49.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.429 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -130.23 141.97 50.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.469 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.8 p -106.38 138.19 43.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.022 0.439 . . . . 0.0 110.531 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.6 tp -60.02 110.46 1.2 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.187 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.454 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.83 165.15 11.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.518 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.92 167.14 9.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.801 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.02 150.62 44.64 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.537 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.11 -2.64 89.34 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.967 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -108.84 156.07 20.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 111.025 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.09 -141.6 23.41 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.276 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -81.07 7.88 9.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.753 0.311 . . . . 0.0 110.623 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.11 30.04 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.847 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.26 139.58 38.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.007 0.432 . . . . 0.0 110.415 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.5 m -80.15 150.5 30.17 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.545 0.688 . . . . 0.0 111.208 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -145.04 -168.6 2.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.658 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.8 mt -128.64 143.86 51.04 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.445 0.64 . . . . 0.0 112.031 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.505 -0.774 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.809 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.568 HD11 HG11 ' A' ' 21' ' ' VAL . 52.1 tp . . . . . 0 C--O 1.231 0.13 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t -55.67 -47.22 77.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.454 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.7 pt -68.78 -16.76 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 67.6 m -101.3 13.76 34.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.889 0.376 . . . . 0.0 110.826 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.5 m -91.56 130.18 37.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.717 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -136.78 159.94 40.34 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.097 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.593 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -124.09 132.03 71.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.654 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.5 mt -79.92 65.73 5.17 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.496 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.6 mm-40 -44.53 -64.53 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.469 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -122.81 165.35 16.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 112.963 -177.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.9 m -156.89 86.51 0.98 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.022 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.2 mt -114.22 158.23 21.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.472 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.8 t -70.24 148.19 48.86 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 177.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.407 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.6 t -51.33 -45.1 32.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -57.82 -52.77 64.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.093 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.7 -43.13 99.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.9 tp -61.47 -48.23 82.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.199 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 92.9 mt-30 . . . . . 0 C--N 1.324 -0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.742 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 9.9 tp10 . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 113.124 0.786 . . . . 0.0 113.124 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.742 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.1 pttm -80.74 -26.06 37.62 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.525 1.53 . . . . 0.0 112.698 -0.398 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -52.16 -57.46 9.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.66 ' H ' ' HG2' ' A' ' 96' ' ' GLU . 1.7 tmtp? -57.08 -52.39 65.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.347 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.425 ' HD1' ' HB2' ' A' ' 96' ' ' GLU . 28.9 m-85 -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.871 0.367 . . . . 0.0 110.599 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 28.3 ttt -71.31 -40.41 70.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.802 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 24.1 ttt -68.35 -35.75 78.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.66 -44.64 70.11 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.479 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 29.2 p -65.93 -38.44 88.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.186 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -68.72 -44.86 72.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.734 179.901 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 . . . . . 0 CA--C 1.527 0.09 0 CA-C-O 121.123 0.487 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.429 HG23 ' HB3' ' A' ' 13' ' ' PHE . 87.8 m -74.03 146.27 43.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.96 133.77 35.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.701 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.5 mt -117.01 141.83 47.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.243 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -61.89 129.7 42.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.067 0.46 . . . . 0.0 110.463 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -12.09 58.05 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.117 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.44 140.75 32.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.096 0.474 . . . . 0.0 111.513 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.28 126.79 32.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.142 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 160' ' ' TRP . 48.2 pt -111.97 159.54 11.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.471 0.653 . . . . 0.0 112.746 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.469 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.2 tp -114.51 108.8 17.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.889 -1.051 . . . . 0.0 109.895 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.408 ' CD2' HD23 ' A' ' 69' ' ' LEU . 67.0 mt -97.01 116.72 29.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.703 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.593 ' NH2' HG21 ' A' ' 68' ' ' VAL . 48.8 ttp85 -102.87 116.49 32.66 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.665 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.2 t-80 -59.47 106.55 0.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 43.1 t -49.76 -47.38 50.97 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 57.5 t80 -64.26 -61.23 2.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.8 t -74.26 -16.83 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.43 -2.77 51.59 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.379 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.2 mtt -83.46 -165.55 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.469 0.176 . . . . 0.0 110.626 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.7 m-85 -133.7 138.86 46.07 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.8 tp -55.65 125.54 21.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.587 ' SG ' HD21 ' A' ' 133' ' ' LEU . 17.7 p -136.26 147.71 47.67 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.4 t -93.15 98.6 11.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.587 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.7 mt -75.53 146.65 40.35 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.374 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -77.95 5.9 8.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.019 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.3 p -97.95 120.56 38.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 66.5 m . . . . . 0 C--N 1.322 -0.617 0 CA-C-O 120.918 0.389 . . . . 0.0 110.264 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.322 0.582 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 11.6 m-85 -100.91 173.32 6.54 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.043 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.51 145.13 24.69 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 93.3 t -114.33 116.1 51.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.174 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.54 -152.82 6.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.002 -1.094 . . . . 0.0 113.246 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 52.4 mt -113.22 143.44 44.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.823 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -129.37 141.13 51.14 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.831 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.85 -52.71 13.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.487 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.504 ' HB3' HG22 ' A' ' 154' ' ' THR . 7.5 m-20 -87.66 151.36 23.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.691 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 67.2 p -104.96 -6.34 20.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.823 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' THR . . . . . 0.504 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.37 115.59 2.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.467 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.14 -159.22 19.73 Favored Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.654 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.507 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -120.53 -13.9 8.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.719 0.295 . . . . 0.0 111.416 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.83 -33.35 66.68 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.6 m -88.62 6.22 39.28 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -110.02 133.75 52.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.146 0.498 . . . . 0.0 111.418 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.485 ' O ' HG12 ' A' ' 119' ' ' ILE . 56.6 m95 -128.56 117.54 21.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.715 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.427 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 14.4 p -79.1 127.64 32.27 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.095 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -89.64 134.83 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.4 m-70 -128.61 151.72 77.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.262 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.705 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.1 Cg_endo -67.85 140.73 51.62 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.5 2.134 . . . . 0.0 112.515 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.83 -44.19 42.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 52.1 m -109.29 -173.64 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.132 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.569 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -90.46 6.15 44.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.147 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.569 HE22 ' HE2' ' A' ' 167' ' ' LYS . 10.5 mm-40 -80.58 -36.53 32.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.488 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.705 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 65.5 mmt-85 -90.0 148.16 23.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.229 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.4 m -127.99 166.8 17.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 111.382 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -66.64 133.81 51.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.235 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.96 -16.91 58.38 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.087 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -67.49 157.3 34.6 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.016 0.436 . . . . 0.0 111.313 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -74.36 140.53 44.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.238 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 88.0 t -90.23 119.84 38.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.371 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -83.61 154.85 23.53 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-O 121.283 0.564 . . . . 0.0 111.406 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 31.6 t -69.55 120.47 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.94 -7.81 35.95 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.376 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -71.45 129.33 38.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 110.853 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.555 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.2 m-20 -70.8 109.84 5.23 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.432 HD21 HG13 ' A' ' 175' ' ' VAL . 63.9 mt -97.14 149.67 21.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.759 0.79 . . . . 0.0 113.035 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 52.8 mt -114.46 112.94 42.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.83 136.7 33.01 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.161 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.45 HG22 ' CD1' ' A' ' 191' ' ' TYR . 74.1 t -128.73 123.13 58.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.735 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 91.4 p -62.5 125.59 24.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 80.1 t -68.7 -32.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.166 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 89.5 p -77.52 -38.49 48.74 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 41.2 t -115.59 2.95 13.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.38 27.17 3.51 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 20.9 mtt180 -107.79 142.5 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.974 0.416 . . . . 0.0 110.927 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.1 m-85 -73.74 154.9 39.41 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.421 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.0 tp -76.42 76.56 3.16 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.0 t60 -76.81 149.41 36.22 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 115.644 1.72 . . . . 0.0 115.644 -174.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -98.7 119.58 37.68 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.639 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.8 p -113.79 144.37 43.1 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -103.81 92.23 4.33 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.521 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -81.82 -176.86 51.44 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.321 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.521 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.3 m-20 4.28 -80.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.406 0.682 . . . . 0.0 112.449 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 37.5 t -145.24 8.2 1.2 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.019 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 57.3 m -122.39 -177.84 3.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.612 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -108.01 138.14 44.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.169 0.509 . . . . 0.0 111.129 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.514 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 17.4 m80 -129.79 173.05 11.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.216 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.58 133.38 67.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.23 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.7 171.22 17.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.71 94.94 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.03 173.29 6.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.005 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -82.41 10.56 6.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.413 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 71.4 mt-30 -116.43 137.64 52.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.523 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -67.12 174.91 2.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 122.297 1.046 . . . . 0.0 113.303 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.4 m -169.16 121.7 0.77 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 112.931 -1.94 . . . . 0.0 107.812 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.4 mt -74.74 130.58 39.73 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.018 0.437 . . . . 0.0 109.838 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -118.52 133.08 56.15 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.083 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 52.2 m -99.78 102.17 13.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.998 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 89.3 t -93.26 102.89 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.13 139.76 24.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.452 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.8 Cg_exo -63.8 105.82 0.58 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.134 1.889 . . . . 0.0 111.174 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.485 HG23 HD21 ' A' ' 62' ' ' LEU . 1.5 mm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.022 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 CA--C 1.518 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.15 121.91 26.7 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.48 157.2 19.2 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.104 0.478 . . . . 0.0 111.17 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -67.89 156.03 38.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.586 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 16' ' ' THR . 14.3 m-20 70.99 -3.29 2.06 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.89 -179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.9 m-20 -73.58 133.23 43.48 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -79.69 119.18 22.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.481 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -135.02 174.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.655 HG11 HD11 ' A' ' 62' ' ' LEU . 3.7 m -134.0 140.94 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.367 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -102.64 116.64 32.99 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.789 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 62.1 mt-30 -119.15 138.42 52.94 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.453 0.644 . . . . 0.0 112.259 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.0 p -123.06 143.8 49.72 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.648 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.7 m -84.35 123.18 29.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.391 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.563 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.59 122.04 45.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.338 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.1 m -125.01 136.21 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.62 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.3 tt -172.75 144.5 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.366 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.0 m80 58.59 37.5 25.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.918 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.441 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.76 26.21 15.5 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.327 179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -128.18 132.61 48.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.33 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -122.77 145.17 48.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.076 0.465 . . . . 0.0 111.396 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.39 178.62 10.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.783 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -124.14 137.41 54.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.513 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.94 132.15 50.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.808 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.8 p -94.11 145.83 24.4 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.418 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.2 tp -69.2 108.94 3.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.081 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -106.18 164.0 12.35 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.305 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.93 164.71 13.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.44 140.86 39.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.659 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.01 17.25 28.36 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.246 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -121.29 146.11 47.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.691 0.282 . . . . 0.0 110.469 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.12 -135.15 14.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.371 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -84.02 9.16 13.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 110.996 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.06 33.63 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.222 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 25.4 mt -79.94 136.15 36.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.976 0.417 . . . . 0.0 110.652 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.9 m -76.9 151.28 35.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.539 0.685 . . . . 0.0 111.219 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -146.02 -170.74 3.55 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.736 -1.12 . . . . 0.0 108.538 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.3 mt -126.41 145.75 50.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.483 0.659 . . . . 0.0 112.06 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.503 -0.855 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.655 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.9 m -51.25 -44.43 61.73 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.497 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.8 pt -72.46 -20.83 19.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.4 m -98.94 13.18 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.75 0.31 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -89.25 129.56 35.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.133 0.492 . . . . 0.0 111.896 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -136.58 162.19 33.8 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.907 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.594 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.9 132.35 70.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.698 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 16.6 mt -80.47 66.7 6.07 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.519 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.3 mm-40 -46.75 -61.91 1.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -122.58 163.05 20.68 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.793 0.806 . . . . 0.0 112.899 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.6 t -156.1 83.33 1.0 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.819 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 mt -113.17 153.75 27.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.557 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.1 t -67.8 147.12 53.0 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 52.6 t -48.79 -44.64 15.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.106 0.479 . . . . 0.0 110.352 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -57.54 -53.7 55.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.225 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.63 -43.37 97.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.787 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.48 -46.68 89.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.349 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 49.8 mt-30 . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 120.807 0.337 . . . . 0.0 110.845 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.8 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 4.8 mm-40 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.8 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 34.2 mtmm -87.17 -51.14 6.16 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 125.059 1.344 . . . . 0.0 111.652 -2.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -58.99 -33.89 71.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.141 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.696 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 32.3 mtmm -62.86 -36.56 83.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.358 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.775 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 37.1 t80 -74.15 -48.0 32.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.885 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.7 ttt -58.31 -37.29 74.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.608 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 45.7 ttm -73.0 -43.86 61.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.827 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.28 -44.14 88.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.915 0.388 . . . . 0.0 110.744 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.2 p -71.29 -40.56 70.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.42 33.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.938 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.89 179.882 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 121.072 0.463 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.0 m -78.71 148.2 33.16 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.124 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.19 132.47 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.672 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.2 mt -116.89 143.78 45.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.215 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -63.88 133.74 53.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.09 0.472 . . . . 0.0 110.469 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.89 -12.44 64.14 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.996 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.98 139.9 33.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.069 0.462 . . . . 0.0 111.509 -179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -82.13 126.51 32.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.7 pt -111.45 160.93 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.536 0.684 . . . . 0.0 112.773 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.432 HD21 HG21 ' A' ' 153' ' ' THR . 20.1 tp -116.97 108.97 16.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.866 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.411 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -96.44 117.72 31.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.613 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.594 ' NH2' HG21 ' A' ' 68' ' ' VAL . 46.8 ttp85 -103.25 116.77 33.09 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.758 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.1 t-80 -59.98 106.48 0.51 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 40.3 t -50.76 -44.99 58.68 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.491 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 49.2 t80 -64.85 -60.58 2.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.477 ' OG ' HD13 ' A' ' 149' ' ' LEU . 58.3 p -77.1 -14.53 59.79 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.26 -0.29 48.67 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.233 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -83.78 -165.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -134.42 140.33 46.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 25.9 tp -55.12 125.91 22.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.2 t -135.2 149.39 49.9 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.1 t -95.91 97.79 9.91 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.6 mt -74.18 151.26 40.04 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.681 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 76.2 p -80.79 6.06 14.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.866 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 77.5 p -93.66 123.03 36.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.0 110.986 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.806 179.824 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.485 0 CA-C-O 121.296 0.57 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.8 m-85 -99.41 169.82 9.06 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.218 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -89.23 140.74 29.18 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.712 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.0 t -110.39 117.66 55.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.57 -147.81 5.76 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.73 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 77.2 mt -117.93 148.6 42.02 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.935 0.397 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -141.67 139.38 32.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.803 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.1 -72.91 0.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.16 149.29 45.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' THR . . . . . 0.432 HG21 HD21 ' A' ' 120' ' ' LEU . 73.9 p -109.98 -2.8 16.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.205 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.2 p -54.84 116.81 2.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.69 -159.36 18.32 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.591 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.545 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.4 mt-10 -120.42 -10.06 9.35 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.809 0.338 . . . . 0.0 111.141 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.03 -31.95 67.5 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.8 m -93.93 9.52 37.1 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -110.49 131.48 55.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.094 0.473 . . . . 0.0 111.409 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.472 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.7 m95 -126.7 116.43 20.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.579 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 9.6 p -78.93 127.39 31.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.24 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.518 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.72 135.21 26.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.405 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 84.5 m-70 -128.22 150.17 73.28 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.158 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.6 Cg_endo -67.36 139.85 51.01 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.668 2.245 . . . . 0.0 112.153 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.25 -44.93 58.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.697 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.422 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 51.0 m -110.98 -171.83 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.249 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 11.26 25.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.227 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.422 ' HG2' ' HB2' ' A' ' 166' ' ' SER . 2.1 mm100 -84.74 -34.59 22.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.112 0.482 . . . . 0.0 110.437 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.708 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.5 mmp_? -92.57 147.21 23.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.14 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 31.3 t -126.52 166.46 17.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.826 0.346 . . . . 0.0 111.298 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.5 OUTLIER -65.56 131.66 46.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.463 179.769 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.87 -14.13 65.9 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.146 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.6 mt-10 -70.51 154.86 41.43 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 111.134 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -70.75 143.75 51.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.518 HG21 HD12 ' A' ' 162' ' ' ILE . 98.2 t -94.02 110.86 24.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.432 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -73.71 153.04 40.23 Favored 'General case' 0 CA--C 1.5 -0.974 0 CA-C-O 121.308 0.575 . . . . 0.0 111.409 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 38.7 t -68.69 121.4 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 176.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.4 -15.26 32.69 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.172 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.05 127.58 32.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 120.833 0.349 . . . . 0.0 110.9 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -68.92 112.25 5.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.484 HD21 HG13 ' A' ' 175' ' ' VAL . 65.3 mt -98.77 149.02 23.3 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.836 0.827 . . . . 0.0 113.166 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.473 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.8 mt -114.57 112.97 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.97 138.98 31.0 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.1 0.476 . . . . 0.0 111.988 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.468 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.9 t -130.77 123.27 54.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.0 t -63.04 122.09 15.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.545 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 79.2 t -65.44 -34.46 70.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 120.806 0.336 . . . . 0.0 111.253 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.9 p -78.03 -39.65 41.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.495 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 49.2 m -113.22 9.63 18.44 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.506 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.56 30.7 0.37 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.718 0.636 . . . . 0.0 112.587 179.257 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.506 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 32.5 mtt85 -111.79 141.4 45.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.939 -179.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 61.3 m-85 -73.0 153.41 40.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.8 tp -75.61 75.65 2.62 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 175.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.407 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 80.8 t60 -75.2 151.63 38.45 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -174.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.9 tp -101.43 119.44 38.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.559 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 35.5 p -113.51 146.73 39.17 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.09 89.61 3.12 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.58 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.23 -174.75 43.88 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.214 -0.994 . . . . 0.0 111.515 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.6 m-80 1.11 -78.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.421 0.688 . . . . 0.0 112.417 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 48.9 m -147.09 10.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.099 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.6 p -125.37 -178.85 4.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.941 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.563 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.0 m95 -107.49 135.3 49.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.273 0.559 . . . . 0.0 111.175 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.58 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 16.0 m80 -126.95 172.72 10.21 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.23 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.32 132.8 70.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.121 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.74 170.52 19.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.549 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.38 96.34 8.3 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.38 -179.46 3.64 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.403 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.6 8.36 28.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.283 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.407 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 82.2 mt-30 -117.21 137.28 52.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.569 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.473 ' NE2' HD13 ' A' ' 182' ' ' ILE . 94.4 mt-30 -64.63 174.51 1.75 Allowed 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 122.295 1.045 . . . . 0.0 112.949 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 210' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.3 m -166.58 121.16 1.11 Allowed 'General case' 0 N--CA 1.44 -0.975 0 CA-C-N 113.13 -1.85 . . . . 0.0 107.994 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.3 mt -74.99 128.94 36.76 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.055 0.455 . . . . 0.0 109.89 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.9 m95 -116.53 147.83 41.42 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.456 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 53.1 m -114.86 99.77 7.73 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.462 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.741 HG22 ' HG ' ' A' ' 22' ' ' LEU . 74.0 t -92.09 101.12 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.842 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 215' ' ' ALA . . . . . 0.415 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -115.58 142.31 28.68 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.056 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.427 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.42 104.32 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.2 1.933 . . . . 0.0 110.995 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.481 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.211 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.25 123.35 27.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 10.5 mmm180 -111.56 156.38 21.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.162 0.505 . . . . 0.0 111.396 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.6 p -67.35 156.62 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.611 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 16' ' ' THR . 8.5 m-20 71.39 -5.05 1.68 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.8 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.2 m-20 -72.68 133.84 44.8 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.684 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.64 121.74 26.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.512 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.24 172.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -177.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.572 HG11 HD11 ' A' ' 62' ' ' LEU . 3.5 m -133.32 136.28 55.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.545 -1.207 . . . . 0.0 108.222 176.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.74 121.96 40.27 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.557 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.458 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 73.7 mt-30 -118.96 161.31 20.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.375 0.607 . . . . 0.0 111.425 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.94 140.82 24.79 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.497 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.3 m -84.21 120.34 26.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.419 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.61 120.79 42.14 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.01 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.9 m -125.4 129.66 50.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.599 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.51 HG23 ' CD2' ' A' ' 29' ' ' HIS . 15.7 tt -165.21 146.28 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.624 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.51 ' CD2' HG23 ' A' ' 28' ' ' ILE . 43.6 m-70 58.47 44.44 18.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.225 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.447 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 60.27 22.23 11.66 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.854 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -127.62 147.5 50.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.482 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -132.75 148.5 52.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.957 0.408 . . . . 0.0 111.179 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -159.47 173.11 16.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -120.66 137.06 54.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.447 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.9 mt -126.24 141.72 51.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.9 p -104.73 141.83 35.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.022 0.439 . . . . 0.0 110.387 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.3 tp -64.31 109.26 1.84 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.121 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.468 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -107.11 162.69 13.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.545 -179.276 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.48 164.52 14.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.65 143.21 35.02 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.679 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.84 12.36 42.53 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.267 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -116.72 150.15 38.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.662 0.268 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.88 -138.34 19.27 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.317 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.6 p30 -84.69 11.93 8.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.661 0.267 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.96 29.55 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.269 179.537 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.65 140.85 38.34 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 120.975 0.417 . . . . 0.0 110.626 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.46 152.56 26.05 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.557 0.694 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -146.49 -169.19 3.21 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.581 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -128.06 143.8 51.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.423 0.63 . . . . 0.0 111.964 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.502 -0.87 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.651 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.572 HD11 HG11 ' A' ' 21' ' ' VAL . 42.9 tp . . . . . 0 C--O 1.232 0.134 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.9 p -53.64 -42.71 68.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.468 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.3 pt -72.18 -17.72 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.5 m -101.92 14.27 32.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.651 0.262 . . . . 0.0 111.226 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.1 m -90.67 128.94 36.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.079 0.466 . . . . 0.0 111.719 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -136.35 159.38 41.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.984 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.561 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.2 t -123.23 132.56 71.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.716 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.06 65.87 5.36 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.2 mm-40 -45.24 -67.09 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.476 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 7.9 mm100 -118.99 164.48 15.41 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.687 0.756 . . . . 0.0 112.82 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.1 t -157.21 82.59 0.92 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.864 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.62 157.37 19.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.419 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.0 t -69.68 146.82 51.29 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.6 t -49.38 -46.06 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 16.8 ttp-105 -55.24 -58.53 7.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.097 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.54 75.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.923 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.3 tp -58.78 -49.32 78.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.243 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 94.7 mt-30 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.781 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.0 mm-40 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.34 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.1 mttt -88.41 -51.37 5.77 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 125.005 1.322 . . . . 0.0 111.225 -3.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -63.2 -28.36 69.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.724 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 23.9 tptm -63.31 -40.76 98.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.119 -0.633 . . . . 0.0 109.912 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.644 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.4 t80 -74.26 -44.12 54.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.949 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.58 -41.28 76.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.391 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.4 tpt -74.97 -41.15 60.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.992 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.464 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.0 ttmp? -57.82 -42.82 85.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.942 0.401 . . . . 0.0 110.552 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 77.0 m -72.06 -48.56 43.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.747 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.1 64.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.8 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.196 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 121.077 0.465 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.468 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 85.6 m -76.25 147.18 38.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.906 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.33 131.12 35.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.756 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.0 mt -115.26 140.9 48.71 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.22 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -61.45 130.04 44.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.008 0.432 . . . . 0.0 110.341 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.35 -13.06 58.54 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.13 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.51 141.28 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.042 0.449 . . . . 0.0 111.359 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.67 128.29 34.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.097 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 41.5 pt -113.39 159.53 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.579 0.704 . . . . 0.0 112.818 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.5 tp -116.09 110.5 18.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.889 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 56.0 mt -97.98 118.01 33.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.469 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.561 ' NH2' HG21 ' A' ' 68' ' ' VAL . 54.4 ttp85 -103.0 116.39 32.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.73 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.529 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.3 t-80 -59.29 105.67 0.36 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 177.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 46.9 t -50.28 -45.56 54.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.529 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.5 t80 -64.2 -61.85 1.99 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.427 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -76.62 -13.75 60.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 72.82 1.34 54.49 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.172 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 53.9 mtt -84.04 -164.98 1.02 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 68.9 m-85 -135.42 138.67 43.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.75 126.2 23.11 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 42.1 t -134.69 148.27 50.28 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.6 t -95.21 96.57 9.28 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.525 -1.216 . . . . 0.0 107.758 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.5 mt -73.96 152.03 40.2 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 89.9 p -83.66 6.41 20.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.083 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.3 p -95.4 121.6 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.724 0.297 . . . . 0.0 111.025 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.772 179.829 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.465 0 CA-C-O 121.401 0.62 . . . . 0.0 112.321 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.53 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.2 m-85 -101.73 170.54 8.1 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.887 -1.051 . . . . 0.0 108.98 178.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.35 142.47 27.7 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 67.7 t -112.71 117.22 54.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.344 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.06 -146.89 5.54 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.844 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 73.1 mt -117.92 152.61 35.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.838 0.352 . . . . 0.0 110.531 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -142.32 140.1 32.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.66 -46.37 46.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.463 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -87.17 143.3 27.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 72.2 p -105.83 -8.54 17.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -53.23 114.44 1.47 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.513 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.91 -155.39 20.19 Favored Glycine 0 N--CA 1.441 -1.028 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.614 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -123.04 -13.94 7.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.704 0.288 . . . . 0.0 111.362 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.53 -32.99 67.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 74.3 m -90.47 8.14 35.33 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -111.55 132.26 54.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.055 0.455 . . . . 0.0 111.486 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.9 m95 -126.75 118.41 24.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.661 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -80.08 126.59 31.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.98 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.444 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -88.19 135.8 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -128.77 150.72 75.72 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.253 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.679 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.16 138.87 53.33 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.585 2.19 . . . . 0.0 112.349 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.19 -40.29 45.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.557 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 96.0 p -109.05 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.6 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.76 5.05 53.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.655 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -85.48 -29.56 24.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.041 0.448 . . . . 0.0 110.866 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.679 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 73.9 mmt-85 -92.11 146.71 23.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.374 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 45.1 t -129.52 167.55 17.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.322 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.24 136.19 56.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.376 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.48 -15.91 55.15 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.459 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 170' ' ' SER . 30.8 mt-10 -68.36 155.48 39.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.026 0.441 . . . . 0.0 111.254 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -73.38 141.47 47.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.43 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 162' ' ' ILE . 98.1 t -91.07 123.1 43.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.375 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -87.69 154.67 20.4 Favored 'General case' 0 CA--C 1.496 -1.126 0 CA-C-O 121.266 0.555 . . . . 0.0 111.405 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.76 120.95 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.62 -11.63 30.3 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.907 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -72.21 126.73 30.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.75 0.309 . . . . 0.0 110.779 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.562 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.4 m-20 -69.49 115.5 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 73.9 mt -100.31 148.26 24.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.763 0.792 . . . . 0.0 112.961 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.445 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.6 mt -113.49 112.75 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 176.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.4 mp -93.16 139.45 30.58 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.073 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 191' ' ' TYR . 71.4 t -130.8 127.8 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.718 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 4.3 m -65.05 124.95 23.44 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 94.2 t -69.1 -32.07 52.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.716 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.88 -36.2 36.9 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 61.3 m -116.64 4.9 13.17 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -177.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.15 31.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.467 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 30.0 mtt85 -112.25 141.69 45.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.2 m-85 -72.88 152.92 41.24 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.418 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 30.5 tp -75.11 76.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.442 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -76.88 150.12 36.04 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.1 tp -99.87 119.09 37.66 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.627 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 55.6 p -113.48 147.7 37.36 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -107.0 90.8 3.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.555 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.2 -174.49 45.7 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.411 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 18.0 m120 0.6 -78.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.397 0.679 . . . . 0.0 112.449 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 57.4 m -147.68 12.85 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.126 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 54.6 m -126.9 -178.14 4.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.56 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.9 m95 -107.88 134.44 50.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.175 0.512 . . . . 0.0 111.158 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.555 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 17.1 m80 -126.46 172.46 10.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.1 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.93 131.59 70.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.237 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -148.73 172.09 15.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.655 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.25 95.54 7.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.022 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.9 -179.03 3.52 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.299 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -88.61 7.94 30.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.442 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.17 138.33 51.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.584 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.445 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.4 mt-30 -68.37 173.41 4.9 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.274 1.035 . . . . 0.0 112.828 -178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -164.79 120.4 1.43 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 113.121 -1.854 . . . . 0.0 107.843 178.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.5 mt -73.89 127.52 33.06 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.47 -0.492 . . . . 0.0 109.943 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.418 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.76 140.92 48.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.731 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.2 t -107.9 100.45 9.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.55 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 65.0 t -92.16 102.93 14.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.781 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.27 142.09 28.13 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.349 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.426 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.2 Cg_exo -63.54 103.99 0.42 Allowed 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.218 1.946 . . . . 0.0 111.165 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.512 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.0 mm . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.295 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.452 ' HB3' HG23 ' A' ' 112' ' ' THR . 68.6 m-85 . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 120.655 0.264 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.1 mt -76.91 120.61 22.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.7 mmm180 -109.87 156.19 20.71 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.066 0.46 . . . . 0.0 111.217 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.0 p -67.1 157.68 33.01 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 70.53 -4.71 1.57 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.426 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.6 m-20 -72.28 133.01 44.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.75 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -79.53 119.84 23.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.54 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.1 m -137.06 172.41 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.68 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 5.4 m -132.71 137.55 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.368 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.773 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -97.8 120.66 38.59 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.854 -0.339 . . . . 0.0 110.535 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 39.2 mt-30 -119.0 159.68 23.41 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.416 0.627 . . . . 0.0 111.521 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.9 p -146.24 140.76 26.78 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.563 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -83.35 124.09 30.29 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.405 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.18 118.5 32.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.914 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.9 m -122.4 136.56 54.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.736 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 tt -176.0 143.84 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.781 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.3 m80 58.03 42.51 22.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.391 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 60.03 22.02 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.426 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -127.19 129.67 48.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.704 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -121.72 144.45 48.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.022 0.439 . . . . 0.0 111.18 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -155.37 175.58 13.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.806 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.9 mtmm -122.36 136.63 54.93 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.561 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.5 mt -126.51 141.28 51.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.64 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.593 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.7 t -105.08 144.8 31.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.976 0.417 . . . . 0.0 110.633 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 130' ' ' LEU . 34.7 tp -64.01 115.34 4.82 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.817 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.432 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.0 163.83 14.62 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.56 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.04 166.83 10.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.753 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.3 144.46 32.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.439 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.63 14.94 38.76 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.288 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -117.64 146.76 43.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.8 0.333 . . . . 0.0 110.693 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -135.24 14.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.538 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -84.3 9.33 13.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.629 0.252 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.59 30.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.177 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.68 139.54 38.49 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.093 0.473 . . . . 0.0 110.712 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.5 m -80.67 152.62 28.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -146.96 -163.91 1.87 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.436 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.28 140.71 49.84 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 112.203 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 . . . . . 0 CA--C 1.504 -0.82 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.673 179.598 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 21' ' ' VAL . 42.0 tp . . . . . 0 N--CA 1.458 -0.059 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.1 p -48.83 -52.65 23.02 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.432 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 31.0 pt -69.94 -15.14 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.68 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.95 -1.87 38.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.2 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.458 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.7 m -84.17 134.01 34.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 0.0 112.199 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -138.2 161.38 37.0 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.952 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.555 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.5 t -125.82 132.12 71.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.727 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.83 64.5 5.63 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.2 mm-40 -43.3 -62.83 0.94 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -178.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.434 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.6 mm-40 -124.74 164.33 20.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.744 0.783 . . . . 0.0 112.716 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.3 t -156.29 84.08 0.99 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.387 -1.279 . . . . 0.0 108.888 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -112.99 154.94 25.67 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.397 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 81.9 p -67.68 150.21 49.01 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.462 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 43.2 t -52.69 -41.94 39.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.055 0.455 . . . . 0.0 110.274 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.9 ttp85 -59.98 -51.44 69.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.13 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.65 91.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.745 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.5 tp -64.18 -44.17 92.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.862 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 53.2 mt-30 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 120.964 0.411 . . . . 0.0 110.469 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.795 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.795 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.5 mttt -88.18 -52.02 5.46 Favored 'General case' 0 C--N 1.352 0.684 0 CA-C-N 120.431 1.469 . . . . 0.0 111.529 -3.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -65.85 -28.76 69.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.033 -1.44 . . . . 0.0 113.071 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 75.7 mmtt -59.51 -48.96 79.62 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.139 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.643 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 74.3 t80 -73.96 -39.53 63.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.564 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.5 ttm -59.87 -38.09 81.2 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.573 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.17 -46.93 30.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.675 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -58.01 -43.83 86.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 62.9 m -72.07 -45.72 59.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.49 -56.56 18.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.288 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.265 -179.842 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 121.138 0.494 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.452 HG23 ' HB3' ' A' ' 13' ' ' PHE . 88.8 m -71.28 146.36 48.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.348 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.39 133.31 35.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.419 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.56 142.31 47.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.994 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -63.25 124.45 21.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.132 0.491 . . . . 0.0 110.484 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.94 -13.64 41.21 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.887 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.48 141.31 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.993 0.425 . . . . 0.0 111.328 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.25 128.45 34.2 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.3 pt -113.01 159.36 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.579 0.704 . . . . 0.0 112.833 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.434 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.42 109.29 17.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.834 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -97.5 116.86 30.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.696 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.555 ' NH2' HG21 ' A' ' 68' ' ' VAL . 61.8 ttp85 -102.67 116.51 32.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.706 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 19.5 t-80 -59.88 106.78 0.53 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.458 ' OG ' HG22 ' A' ' 66' ' ' THR . 41.5 m -52.06 -43.45 63.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -176.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.47 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 56.4 t80 -66.0 -58.67 5.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.0 m -79.12 -13.3 59.82 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLY . . . . . 0.447 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 72.18 -0.85 37.13 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.307 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.2 mtt -83.24 -165.47 1.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -133.94 139.0 45.84 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 37' ' ' LEU . 23.5 tp -55.77 124.95 19.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.1 t -133.36 148.08 51.84 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -176.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -94.19 98.76 11.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.1 mt -76.91 147.34 37.06 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.578 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -78.89 6.22 9.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.911 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.9 p -92.2 124.1 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.879 -179.841 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.446 -0.666 0 CA-C-O 121.048 0.451 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.7 m-85 -99.87 171.09 8.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.272 178.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -90.17 143.59 26.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.031 0.443 . . . . 0.0 109.935 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.21 116.0 51.38 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.311 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.64 -151.75 6.61 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.91 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 46.3 mt -113.51 149.14 34.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -140.38 140.06 35.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.69 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -74.17 -49.4 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.551 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.01 143.85 30.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.834 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.5 p -106.47 -7.81 17.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.707 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.3 p -52.88 114.96 1.6 Allowed 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.636 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.75 -157.04 19.67 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.712 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.503 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -120.16 -13.9 8.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.759 0.314 . . . . 0.0 111.338 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 68.4 m -90.63 8.05 36.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -110.84 132.58 54.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.042 0.449 . . . . 0.0 111.241 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.453 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.4 m95 -127.03 116.23 20.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.721 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.3 p -78.3 125.18 28.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.476 HD12 HG21 ' A' ' 175' ' ' VAL . 3.7 pt -86.92 136.66 22.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.844 0.354 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 75.3 m-70 -128.58 149.04 70.76 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.095 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.645 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 33.9 Cg_endo -65.31 137.07 49.93 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.455 2.103 . . . . 0.0 112.511 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.408 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -78.22 -40.1 38.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.426 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 78.4 p -105.95 -171.21 1.86 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.406 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -95.03 -7.25 40.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.408 ' NE2' ' N ' ' A' ' 168' ' ' GLN . 1.7 mp0 -72.99 -32.39 65.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.022 0.439 . . . . 0.0 110.883 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.645 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.2 mmp_? -90.25 146.66 24.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.499 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.2 m -130.15 167.22 18.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.126 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -66.77 128.79 37.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.337 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 96.11 -13.55 65.76 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -70.55 156.39 39.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.045 0.45 . . . . 0.0 111.283 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.409 ' HD3' ' CZ ' ' A' ' 13' ' ' PHE . 34.9 mttp -73.91 139.67 45.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.456 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.476 HG21 HD12 ' A' ' 162' ' ' ILE . 93.1 t -89.7 119.53 36.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.213 179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ARG . . . . . 0.422 ' HD3' ' CD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -83.8 153.71 23.93 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 121.246 0.546 . . . . 0.0 111.516 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 13.6 t -68.6 118.31 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.67 -8.01 29.97 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.276 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.14 136.34 44.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.79 0.329 . . . . 0.0 110.802 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 38.6 m-20 -76.98 114.2 15.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.414 HD21 HG13 ' A' ' 175' ' ' VAL . 64.4 mt -99.64 149.25 23.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.755 0.788 . . . . 0.0 112.955 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.511 HD13 ' NE2' ' A' ' 209' ' ' GLN . 66.3 mt -114.62 112.17 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 176.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -91.8 139.44 30.67 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.089 0.471 . . . . 0.0 112.156 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.46 HG22 ' CD1' ' A' ' 191' ' ' TYR . 72.7 t -131.88 121.74 47.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.902 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 95.6 p -61.42 120.27 10.15 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.503 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 91.7 t -63.38 -34.03 64.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.319 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.6 p -77.73 -39.33 44.84 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.7 m -113.71 7.39 17.18 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.39 31.29 1.24 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.461 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 22.1 mtt180 -112.7 140.65 47.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.96 0.409 . . . . 0.0 110.812 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 50.8 m-85 -72.91 152.97 41.2 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.428 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 37.4 tp -74.92 77.56 2.16 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 175.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -77.5 150.61 34.84 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -174.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.0 tp -100.43 117.81 35.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.589 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 43.0 t -111.32 145.7 38.36 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.45 90.17 3.33 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.587 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.37 -175.55 45.49 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.432 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' A' ' 197' ' ' GLY . 9.9 m120 1.16 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.449 0.7 . . . . 0.0 112.459 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 77.3 p -146.13 10.62 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.153 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 67.3 p -125.23 -177.88 4.02 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.992 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.6 m95 -108.23 137.3 46.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 111.206 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.587 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 16.6 m80 -129.22 172.47 11.42 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.027 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.54 134.7 65.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.246 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -153.06 170.93 19.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.509 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.06 94.47 6.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.82 178.18 4.38 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.402 -177.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -86.41 10.97 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -119.5 136.83 54.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.511 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.3 mt-30 -65.07 176.3 1.31 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 122.399 1.095 . . . . 0.0 113.143 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.5 m -169.28 120.43 0.72 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 112.946 -1.933 . . . . 0.0 107.729 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 22.4 mt -74.6 127.58 33.44 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.041 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.428 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.7 m95 -114.34 141.82 47.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.733 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.3 t -108.87 100.44 9.65 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.524 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.773 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.8 t -91.82 102.13 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.682 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.87 141.96 27.65 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.233 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.403 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.76 104.46 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.033 1.822 . . . . 0.0 111.316 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.54 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.202 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 . . . . . 0 CA--C 1.519 -0.249 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 34.4 mt -79.58 122.32 26.35 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.8 mmm180 -110.17 157.3 19.54 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.018 0.437 . . . . 0.0 111.272 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.6 p -67.79 155.22 39.82 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.889 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.66 -7.89 1.49 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.624 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 69' ' ' LEU . 5.1 m-20 -69.15 137.94 53.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.767 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -84.39 119.38 25.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.0 m -136.15 170.03 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.699 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.4 m -132.14 139.65 49.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.414 176.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.799 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -100.58 119.72 38.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.7 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 43.6 mt-30 -117.6 163.34 16.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 121.298 0.57 . . . . 0.0 111.374 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.25 144.24 25.46 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.2 m -87.41 123.29 32.2 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.621 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.576 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.04 121.18 42.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.885 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.5 m -124.73 132.91 53.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.714 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.3 tt -172.0 148.88 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.644 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.3 m80 58.75 41.44 21.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.43 21.93 11.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.39 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -126.34 150.12 48.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.534 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -135.38 146.47 48.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.91 0.386 . . . . 0.0 110.839 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.455 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.7 pt20 -158.37 172.01 19.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.763 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -118.7 137.09 53.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.534 178.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.455 HD21 ' OE1' ' A' ' 33' ' ' GLN . 2.2 mt -127.37 140.75 51.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.746 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 53.6 t -104.47 146.97 28.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.926 0.393 . . . . 0.0 110.259 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.9 tp -66.57 112.23 4.03 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.799 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.48 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.32 163.72 13.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.436 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.433 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -167.01 162.72 15.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.912 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.71 144.02 45.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.68 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.55 18.81 31.76 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.167 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -124.33 146.57 48.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.841 0.353 . . . . 0.0 110.607 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.15 -137.65 18.78 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.434 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -80.89 7.76 9.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.655 0.264 . . . . 0.0 110.922 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.18 32.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.046 179.669 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.1 mt -78.72 135.43 37.15 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.982 0.42 . . . . 0.0 110.693 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -75.57 150.35 38.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.569 0.699 . . . . 0.0 111.33 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -144.39 -165.84 2.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.502 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 37' ' ' LEU . 35.0 mt -129.99 143.6 50.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.395 0.617 . . . . 0.0 112.238 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.504 -0.813 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.674 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.633 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp . . . . . 0 CA--C 1.526 0.034 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.9 m -48.43 -49.64 34.38 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.48 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.7 pt -72.67 -16.92 18.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.856 -179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.699 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -99.09 -1.07 40.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.409 -178.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 ' OG ' ' A' ' 124' ' ' SER . 31.3 m -86.18 132.2 34.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 112.187 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -136.41 161.51 35.62 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.043 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.575 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.41 133.66 68.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.751 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 121' ' ' LEU . 17.9 mt -82.34 65.59 7.55 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.4 mm-40 -44.42 -63.91 0.79 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 56.1 mm-40 -123.78 164.74 18.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.69 0.757 . . . . 0.0 112.742 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.21 86.98 1.03 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.068 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.2 mt -113.73 156.08 24.44 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.138 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.8 t -69.19 149.35 48.69 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 49.6 t -51.34 -44.4 31.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.074 0.464 . . . . 0.0 110.361 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.4 ttp-105 -56.99 -57.04 14.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.985 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.14 -43.17 87.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.633 -179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.36 -48.02 83.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.076 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 54.0 mt-30 . . . . . 0 C--N 1.323 -0.578 0 CA-C-O 121.007 0.432 . . . . 0.0 110.584 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.768 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 25.1 mm-40 . . . . . 0 CA--C 1.534 0.355 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.723 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.712 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 16.6 ptpt -86.66 -49.63 7.37 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.21 1.404 . . . . 0.0 111.304 -3.059 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -54.19 -41.48 68.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.854 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 66.1 tttp -59.56 -31.07 69.08 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.95 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.768 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.1 t80 -73.3 -44.94 58.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.43 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 68.1 mmm -56.79 -46.96 81.21 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.07 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 57.2 ttp -68.84 -42.82 76.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.336 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -57.68 -45.8 85.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.849 0.356 . . . . 0.0 110.856 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 36.5 m -68.54 -43.54 76.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.846 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.59 72.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.859 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.83 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 121.095 0.474 . . . . 0.0 111.315 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 80.9 m -74.25 147.18 42.65 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.53 130.48 35.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -114.95 141.66 47.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.159 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.94 125.4 23.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 105.17 -12.28 48.49 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.121 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.41 142.29 32.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.081 0.467 . . . . 0.0 111.237 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.92 126.41 32.45 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.5 pt -112.19 159.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.449 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 19.1 tp -114.38 109.24 18.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.877 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.441 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.11 116.22 28.92 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.779 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.575 ' NH2' HG21 ' A' ' 68' ' ' VAL . 58.7 ttp85 -101.86 116.5 32.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.715 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.4 t-80 -59.8 106.22 0.46 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.465 ' OG ' HG22 ' A' ' 66' ' ' THR . 62.0 m -49.18 -46.5 45.6 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 63.3 t80 -64.06 -64.26 0.94 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.401 ' HG ' ' CE1' ' A' ' 123' ' ' HIS . 14.7 m -72.69 -14.79 61.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.1 -1.45 40.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.179 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 49.3 mtt -82.01 -165.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.525 0.203 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 66.6 m-85 -134.6 138.69 44.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.484 HD13 HD21 ' A' ' 37' ' ' LEU . 25.1 tp -54.99 126.14 23.34 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.4 t -134.71 147.77 50.15 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.0 t -95.48 98.12 10.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.0 mt -75.02 149.54 39.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -80.84 5.96 14.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.783 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.8 p -90.32 122.83 33.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.737 0.303 . . . . 0.0 111.074 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.8 179.845 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.242 0.544 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.54 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -100.83 170.79 8.08 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.166 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -89.43 143.76 26.57 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 120.995 0.426 . . . . 0.0 109.949 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.4 t -113.49 118.0 56.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.312 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.48 -148.43 5.51 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.98 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.455 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 52.2 mt -115.92 151.29 35.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.077 0.465 . . . . 0.0 110.831 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -141.15 139.94 34.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.579 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -73.35 -52.87 12.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -82.57 147.05 28.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 58.2 p -105.49 -5.03 20.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -55.74 113.08 1.33 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.453 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.47 -159.61 21.45 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.593 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 36.5 mt-10 -118.79 -13.26 9.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.808 0.337 . . . . 0.0 111.428 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.94 -32.88 66.44 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 64.9 m -91.17 7.19 41.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.19 133.98 52.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.016 0.436 . . . . 0.0 111.253 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.44 ' O ' HG12 ' A' ' 119' ' ' ILE . 57.3 m95 -128.8 117.72 21.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.822 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.433 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 13.6 p -79.08 125.65 29.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.112 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.01 136.11 23.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.94 0.4 . . . . 0.0 110.943 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.6 m-70 -128.76 151.41 77.15 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.305 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.704 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.1 Cg_endo -67.51 140.93 53.81 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.598 2.199 . . . . 0.0 112.274 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -44.52 53.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.847 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -110.8 -170.85 1.72 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.248 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.534 ' HE3' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -92.44 9.26 35.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.149 -179.819 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.534 HE22 ' HE3' ' A' ' 167' ' ' LYS . 9.9 mm-40 -83.03 -35.25 25.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.548 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.704 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 77.3 mmt-85 -91.96 146.56 23.64 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.299 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 46.1 t -123.95 165.52 17.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.398 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.18 129.46 40.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.23 -13.53 64.54 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.851 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.49 156.09 39.83 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.401 ' HG2' HG21 ' A' ' 112' ' ' THR . 37.6 mttp -72.81 140.51 47.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.473 HG21 HD12 ' A' ' 162' ' ' ILE . 93.4 t -90.25 120.06 38.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.534 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -83.85 155.64 22.83 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 121.344 0.593 . . . . 0.0 111.533 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.429 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.0 t -71.13 120.33 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.08 -11.69 31.67 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.167 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -70.67 129.82 40.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.742 0.306 . . . . 0.0 110.907 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.578 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.5 m-20 -71.41 114.81 9.87 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.409 HD21 HG13 ' A' ' 175' ' ' VAL . 69.2 mt -100.43 148.11 25.11 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.507 HD13 ' NE2' ' A' ' 209' ' ' GLN . 50.7 mt -113.64 113.39 43.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -93.12 137.1 32.77 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.167 0.508 . . . . 0.0 112.107 -178.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.436 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.7 t -129.14 121.1 53.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 86.5 p -61.31 124.19 19.9 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.6 t -67.81 -32.25 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.172 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 98.2 p -77.52 -37.75 50.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.5 m -116.58 6.94 13.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.55 31.39 1.33 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.4 mtt85 -111.8 143.69 42.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.827 0.346 . . . . 0.0 110.862 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.5 m-85 -74.87 154.01 38.41 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -76.14 76.05 2.98 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.6 t60 -76.54 149.64 36.65 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -174.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.2 tp -98.75 119.09 36.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.966 -1.47 . . . . 0.0 107.614 176.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 44.5 t -113.07 146.74 38.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -105.46 92.67 4.29 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.696 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -76.03 -170.31 29.62 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.0 p30 -11.22 -67.57 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.439 0.695 . . . . 0.0 112.812 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 56.9 m -153.22 12.41 0.48 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 0.0 109.89 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 51.7 m -128.4 -179.8 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.576 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.8 m95 -106.5 135.31 48.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 111.245 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.696 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 13.7 m80 -127.53 173.54 9.78 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.916 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -129.06 128.49 67.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.236 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -144.94 172.09 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.746 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.99 95.98 7.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.39 -179.98 3.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.323 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -88.3 10.21 20.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.903 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 75.0 mt-30 -117.87 137.13 52.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.575 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.507 ' NE2' HD13 ' A' ' 182' ' ' ILE . 95.8 mt-30 -67.27 175.7 2.57 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.341 1.067 . . . . 0.0 113.039 -178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.5 m -168.76 121.65 0.82 Allowed 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.065 -1.88 . . . . 0.0 107.748 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.6 mt -74.33 130.55 39.9 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.837 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.437 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.2 m95 -118.44 125.32 49.69 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 121.416 0.627 . . . . 0.0 111.343 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.6 m -91.08 101.11 13.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.157 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.799 HG22 ' HG ' ' A' ' 22' ' ' LEU . 98.1 t -93.57 103.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.765 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.82 142.24 28.05 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.218 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.447 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.5 Cg_exo -63.6 104.23 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.218 1.946 . . . . 0.0 111.265 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.296 -0.859 . . . . 0.0 111.167 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 . . . . . 0 CA--C 1.517 -0.291 0 CA-C-O 120.93 0.395 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.28 123.18 27.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -109.49 157.08 19.34 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.016 0.436 . . . . 0.0 111.296 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 6.1 p -67.79 156.08 37.84 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.66 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.15 -9.18 1.18 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.771 -179.067 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.5 m-20 -67.88 132.61 47.68 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -79.47 122.28 26.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.568 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.1 m -138.26 171.44 15.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.567 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -132.71 136.49 55.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.163 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.76 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.9 mp -97.16 123.87 41.06 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.556 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' NE2' ' HE2' ' A' ' 34' ' ' LYS . 35.0 mt-30 -124.78 145.99 49.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.714 0.769 . . . . 0.0 112.326 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.3 p -132.88 143.64 49.65 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.711 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -86.88 120.23 27.94 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.992 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.609 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -109.81 119.2 38.62 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.372 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.3 m -123.66 141.73 51.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.345 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' ND1' ' A' ' 29' ' ' HIS . 21.2 tt -170.65 140.03 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.86 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.473 ' ND1' HG12 ' A' ' 28' ' ' ILE . 3.6 p-80 38.46 58.4 1.62 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.517 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 6.5 mmmm 58.27 35.61 25.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.965 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -139.0 113.78 9.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -117.95 148.07 42.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.461 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -163.01 173.54 13.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.549 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE2' ' NE2' ' A' ' 23' ' ' GLN . 39.1 mtpt -118.56 136.84 53.63 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.668 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.5 mt -127.98 142.08 51.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.324 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.7 p -105.66 142.12 35.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.072 0.463 . . . . 0.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -63.71 112.9 3.06 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.047 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.469 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.49 164.07 13.72 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.581 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.9 165.0 14.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.597 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -139.44 146.4 40.04 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.656 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.15 10.84 59.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -121.29 153.58 37.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.743 0.306 . . . . 0.0 110.658 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.7 -135.89 15.07 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.318 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -87.13 8.21 24.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.658 0.266 . . . . 0.0 110.87 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.14 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.651 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 55.6 mt -80.32 140.44 36.14 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.773 0.32 . . . . 0.0 110.544 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.629 ' SG ' HG13 ' A' ' 203' ' ' VAL . 29.6 p -81.05 150.9 28.64 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 111.112 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -144.4 -166.47 2.39 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.838 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 48.3 mt -130.47 144.93 51.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.335 0.588 . . . . 0.0 112.208 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.9 mt-10 . . . . . 0 CA--C 1.503 -0.849 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.604 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 HG11 ' A' ' 21' ' ' VAL . 48.5 tp . . . . . 0 N--CA 1.457 -0.109 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.6 m -51.83 -46.78 64.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.268 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.469 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.3 pt -70.68 -18.72 21.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 32.5 m -99.9 12.33 37.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.716 0.293 . . . . 0.0 111.073 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -90.14 129.35 36.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 111.841 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -136.17 161.22 36.33 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.148 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.572 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.27 132.21 71.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.612 178.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.8 mt -80.84 65.81 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.507 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 13.2 mm-40 -44.67 -66.9 0.33 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.483 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 53.5 mm-40 -121.25 164.24 17.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.611 0.719 . . . . 0.0 112.895 -177.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -154.76 86.55 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.285 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 mt -113.91 154.47 27.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.387 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.2 t -68.58 146.25 53.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.0 t -45.86 -49.08 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.187 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -52.6 -53.84 41.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.926 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.77 -53.48 57.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.0 tp -51.49 -45.41 62.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.237 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 120.947 0.403 . . . . 0.0 110.284 179.646 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.803 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.7 mm-40 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.76 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.763 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 95.3 mttt -86.03 -50.43 7.05 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 120.13 1.332 . . . . 0.0 111.409 -2.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -54.45 -44.14 72.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.057 -177.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 98.8 mttt -56.07 -34.94 66.43 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.356 -179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.803 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -73.84 -42.48 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.705 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 56.1 tpp -57.33 -41.25 79.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.543 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 54.2 ttp -73.12 -43.03 62.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.554 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.9 ttmp? -58.05 -42.59 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.055 0.455 . . . . 0.0 110.307 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.0 m -72.58 -40.43 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.9 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.86 -39.19 84.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.091 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.587 179.858 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 15.0 ptm180 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.138 0.494 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.4 m -72.65 147.45 45.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.196 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.55 129.58 34.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.695 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -113.03 143.6 44.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.374 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.503 ' HD2' ' HG2' ' A' ' 173' ' ' GLU . 38.0 m-85 -62.66 143.9 56.86 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.115 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 86.07 -14.99 51.41 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.557 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.496 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.5 OUTLIER -79.81 141.98 35.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.138 0.494 . . . . 0.0 111.611 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.54 127.18 33.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.226 177.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.9 pt -112.0 162.62 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.575 0.702 . . . . 0.0 112.855 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.483 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.2 tp -117.36 109.95 17.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.96 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.1 mt -98.02 116.25 29.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.767 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.572 ' NH2' HG21 ' A' ' 68' ' ' VAL . 57.9 ttp85 -102.83 116.8 33.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.787 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.9 t-80 -59.39 107.1 0.52 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.6 t -48.66 -50.26 33.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.457 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.5 t80 -61.49 -66.67 0.5 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.422 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.9 p -67.41 -21.36 65.59 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.4 -2.01 68.69 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.157 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -83.06 -165.61 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.465 0.174 . . . . 0.0 110.659 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.3 m-85 -134.03 139.66 46.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.6 tp -55.55 125.31 20.45 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.7 t -133.84 148.23 51.28 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 50.5 t -95.07 98.13 10.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.513 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.67 155.75 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.263 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.8 t -86.43 6.61 29.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.943 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.8 p -92.32 124.21 36.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.655 0.264 . . . . 0.0 111.081 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 0.0 110.806 179.917 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.31 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.4 m-85 -104.79 176.07 5.28 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.433 177.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.41 141.75 28.22 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.593 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 59.9 t -111.21 125.87 68.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -141.41 -151.58 5.58 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.562 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 76.8 mt -115.77 143.94 44.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.042 0.448 . . . . 0.0 110.841 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -133.69 141.07 47.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.932 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.14 -64.02 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.54 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.89 149.1 36.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.716 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.1 p -103.46 1.32 32.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.948 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.2 p -55.69 114.46 1.88 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.73 -161.29 18.13 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.606 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.0 mt-10 -118.2 -11.38 10.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.75 0.31 . . . . 0.0 111.146 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.83 66.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.04 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.4 m -90.21 7.66 37.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.722 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -111.17 132.03 54.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.399 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.476 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.9 m95 -127.28 116.42 20.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.676 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 12.8 p -78.85 125.24 29.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.152 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.03 137.07 21.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.818 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 86.7 m-70 -130.8 149.21 73.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.264 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.615 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 23.7 Cg_endo -64.36 137.76 57.27 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.323 2.015 . . . . 0.0 112.244 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.1 49.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.742 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 68.6 m -113.15 -167.61 1.21 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 167' ' ' LYS . 8.1 tmtm? -91.41 1.48 57.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.78 -26.53 34.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.615 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 14.6 mmp_? -94.14 145.67 24.53 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.478 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 173' ' ' GLU . 69.4 m -111.63 152.63 27.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.047 -178.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' GLU . . . . . 0.523 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.1 OUTLIER -71.72 132.11 44.07 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 79.77 -4.53 64.87 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.541 ' HB3' ' O ' ' A' ' 170' ' ' SER . 0.0 OUTLIER -79.16 154.8 29.02 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.66 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 173' ' ' GLU . 81.5 mttt -59.05 138.32 57.59 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.225 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 90.1 t -93.75 116.93 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.104 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ARG . . . . . 0.432 ' HB2' ' OD2' ' A' ' 179' ' ' ASP . 11.1 mpt_? -80.03 154.01 28.45 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.177 0.513 . . . . 0.0 111.519 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 42.2 t -68.73 122.53 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 176.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.75 -13.5 35.13 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.23 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 169' ' ' ARG . 71.1 m-20 -68.36 129.1 38.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.79 0.329 . . . . 0.0 110.719 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -71.86 112.81 8.28 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.442 HD21 HG13 ' A' ' 175' ' ' VAL . 65.2 mt -97.29 150.66 20.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.834 0.826 . . . . 0.0 113.158 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.538 HD13 ' NE2' ' A' ' 209' ' ' GLN . 43.9 mt -115.21 113.97 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 176.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.99 135.01 35.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.001 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.456 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.0 t -127.55 122.06 58.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.933 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 29.5 t -62.23 122.03 14.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -67.08 -30.86 50.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.025 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.49 -40.0 36.64 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.9 m -115.13 7.78 15.47 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.56 31.63 1.4 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 190' ' ' ARG . 4.9 mtt-85 -113.13 142.26 45.96 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -73.54 153.33 40.32 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.5 tp -75.12 76.33 2.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 175.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.496 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.2 t60 -76.32 151.29 36.73 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.93 115.19 29.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 113.604 -1.634 . . . . 0.0 107.731 177.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 67.7 m -107.86 147.46 30.91 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -106.72 92.26 4.03 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.666 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.47 -173.46 39.75 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.341 -0.933 . . . . 0.0 111.594 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' A' ' 197' ' ' GLY . 10.5 p-10 -5.55 -71.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 199' ' ' SER . . . . . 0.415 ' H ' ' CG ' ' A' ' 198' ' ' ASN . 54.3 m -151.97 13.83 0.61 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 31.2 t -127.86 -179.33 4.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.742 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.609 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.3 m95 -108.08 134.99 50.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.223 0.535 . . . . 0.0 111.321 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.666 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 13.4 m80 -127.51 177.96 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.942 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 203' ' ' VAL . . . . . 0.629 HG13 ' SG ' ' A' ' 47' ' ' CYS . 3.0 p -132.36 130.2 60.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.47 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 54.7 p-10 -146.56 173.97 11.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.632 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.06 91.76 4.93 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -110.43 -179.51 3.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -87.73 5.03 41.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.484 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.496 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 65.8 mt-30 -112.99 137.95 50.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.635 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.538 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.2 mt-30 -64.86 175.23 1.56 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 122.35 1.072 . . . . 0.0 112.852 -178.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.8 m -168.17 119.96 0.83 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 112.997 -1.911 . . . . 0.0 107.846 178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 25.1 mt -74.56 129.34 37.56 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.436 -0.505 . . . . 0.0 109.996 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 99.0 m95 -116.42 145.43 43.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.521 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -112.47 99.86 8.31 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.345 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.76 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.5 t -91.46 99.98 10.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.573 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.63 140.47 23.92 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.3 Cg_exo -62.36 103.97 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.097 1.865 . . . . 0.0 111.141 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.568 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.6 mm . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.295 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.8 mt -82.85 118.74 23.64 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.6 mmm180 -107.36 158.13 17.4 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.242 0.544 . . . . 0.0 111.342 -179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -68.41 154.44 41.81 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 72.46 -2.91 2.47 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.786 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.436 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.1 m-20 -73.82 138.44 44.45 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.741 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -84.34 121.18 27.17 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.554 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.7 m -137.5 169.73 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.7 137.04 56.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 114.678 -1.147 . . . . 0.0 108.277 176.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.745 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.3 mp -97.8 123.91 41.96 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.614 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 74.2 mt-30 -124.56 146.75 48.85 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.544 0.688 . . . . 0.0 112.194 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.23 143.67 49.28 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.746 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 m -86.56 120.48 27.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.213 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.62 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.74 121.09 44.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.179 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.8 m -125.75 133.13 52.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.004 0.43 . . . . 0.0 111.775 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.476 HG23 ' CD2' ' A' ' 29' ' ' HIS . 16.9 tt -169.85 146.56 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.382 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.476 ' CD2' HG23 ' A' ' 28' ' ' ILE . 37.1 m-70 57.68 43.7 21.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.02 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.8 OUTLIER 58.91 23.57 11.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.364 179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.03 144.12 50.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.371 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -132.0 147.6 52.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.917 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -161.35 171.13 18.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 21.6 mtpp -118.85 139.12 52.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.381 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.5 mt -127.9 144.24 51.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.303 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.6 p -108.37 139.83 42.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 0.0 110.693 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.1 tp -62.13 113.23 2.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.1 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.37 168.3 9.97 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.597 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -172.74 165.34 5.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.66 150.97 48.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.511 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.26 -0.35 88.58 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.816 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -113.96 153.87 28.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.868 0.366 . . . . 0.0 111.056 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.38 -128.24 8.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.523 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.0 t-20 -91.31 3.87 53.78 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.749 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 43.12 28.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.584 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 mt -81.31 133.87 35.5 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.418 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.7 m -72.63 150.2 43.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -145.94 -170.39 3.47 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.503 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.489 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.1 mt -129.17 143.28 50.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.497 0.665 . . . . 0.0 112.45 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.4 mt-10 . . . . . 0 CA--C 1.502 -0.879 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.765 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp . . . . . 0 C--O 1.231 0.126 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.0 m -52.28 -50.22 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 29.8 pt -68.6 -17.34 22.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 51.4 m -100.27 11.4 39.47 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.826 0.346 . . . . 0.0 111.03 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -90.22 130.11 36.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.11 0.481 . . . . 0.0 111.689 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -136.45 160.83 37.58 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.102 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.3 t -124.83 132.57 71.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.863 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.436 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.6 mt -80.9 64.33 5.62 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.523 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.6 mm-40 -43.5 -64.02 0.73 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.465 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 58.4 mm-40 -123.18 162.93 21.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.707 0.765 . . . . 0.0 112.888 -177.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.6 m -154.13 84.9 1.14 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.987 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 mt -113.18 154.19 27.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.187 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.54 ' HB3' HH12 ' A' ' 76' ' ' ARG . 47.4 t -67.76 149.1 50.37 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 48.5 t -49.94 -43.86 20.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.88 0.371 . . . . 0.0 110.276 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.54 HH12 ' HB3' ' A' ' 74' ' ' SER . 1.9 tmm_? -58.7 -52.94 63.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.22 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.421 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -59.51 -44.11 93.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.702 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.9 tp -62.24 -48.06 81.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.345 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 120.816 0.341 . . . . 0.0 110.543 179.851 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.689 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.8 mm-40 . . . . . 0 CA--C 1.531 0.25 0 CA-C-O 119.164 -0.446 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.652 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 25.1 tptp -87.75 -38.2 15.98 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 124.5 1.12 . . . . 0.0 109.942 -4.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -53.62 -44.64 69.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.697 -178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -61.69 -27.7 68.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.211 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.689 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 66.4 t80 -74.25 -49.44 23.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.501 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 58.6 ttp -60.66 -38.84 86.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.846 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.1 mtp -72.13 -45.4 60.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.014 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -59.15 -41.07 87.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.837 0.351 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 55.2 p -71.91 -43.81 64.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.91 -29.59 70.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.797 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 . . . . . 0 CA--C 1.527 0.078 0 CA-C-O 121.373 0.606 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.4 m -81.49 150.55 28.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.838 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.42 130.44 35.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.734 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.5 mt -115.49 143.25 45.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.142 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -63.97 129.68 41.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.039 0.447 . . . . 0.0 110.49 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.43 -11.71 58.25 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.944 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.01 141.09 31.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.091 0.472 . . . . 0.0 111.388 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.02 127.18 33.33 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 160' ' ' TRP . 40.5 pt -110.99 163.52 7.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.541 0.686 . . . . 0.0 112.602 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.465 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.5 tp -118.81 108.46 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.752 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.417 ' CD2' HD23 ' A' ' 69' ' ' LEU . 57.7 mt -96.75 117.47 31.11 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.739 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.523 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 18.9 ttp180 -104.02 116.69 32.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.553 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.45 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.8 t-80 -59.82 106.68 0.51 Allowed 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.7 t -49.83 -45.31 50.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 31.8 t80 -67.01 -59.88 3.11 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.9 m -74.72 -14.74 60.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.26 -2.84 26.05 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.376 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' MET . . . . . 0.428 ' HB2' ' HB3' ' A' ' 149' ' ' LEU . 50.1 mtt -82.95 -165.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.4 m-85 -132.94 138.9 47.07 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.2 tp -54.78 126.03 22.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.579 ' SG ' HD21 ' A' ' 133' ' ' LEU . 16.7 p -136.34 148.66 48.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.3 t -94.82 97.4 10.01 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.726 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.579 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.0 mt -72.89 154.86 40.4 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.458 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -83.0 2.31 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.186 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.5 p -95.74 120.97 36.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.78 0.324 . . . . 0.0 111.107 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 78.0 p . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.551 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.515 -0.377 0 CA-C-O 121.482 0.658 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.2 m-85 -100.54 170.24 8.51 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.113 177.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -89.38 145.1 25.57 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.7 t -113.89 117.14 54.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.529 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.23 -151.54 6.45 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.987 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.9 mt -115.71 141.72 47.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.423 . . . . 0.0 110.731 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.498 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -130.92 140.72 50.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.695 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.86 -69.01 0.37 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.585 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.96 148.41 46.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.685 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.0 p -104.21 0.16 29.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.127 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -55.54 112.77 1.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.436 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.17 -160.22 20.57 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.672 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.482 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 32.0 mt-10 -118.95 -10.73 9.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.98 -33.13 66.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 82.5 m -91.84 9.69 31.74 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.18 132.5 54.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 0.0 111.353 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.463 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -128.44 116.66 20.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.728 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 15.5 p -78.6 126.73 31.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.252 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.496 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.93 136.77 22.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.879 0.371 . . . . 0.0 110.887 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -130.77 150.3 76.06 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.315 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.719 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 39.5 Cg_endo -66.49 141.01 59.52 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.664 2.242 . . . . 0.0 112.295 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.52 -46.31 48.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.78 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 21.3 t -113.61 -177.23 3.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.126 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.494 ' HD2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -85.31 15.23 4.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.281 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.494 HE22 ' HD2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -85.89 -36.25 20.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.196 0.522 . . . . 0.0 110.2 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.719 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.8 mmp_? -93.89 148.23 22.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.061 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 49.1 m -125.12 166.71 15.93 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.234 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.47 133.44 50.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.186 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 90.83 -12.07 69.95 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.302 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.8 mt-10 -72.42 154.6 40.8 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 120.999 0.428 . . . . 0.0 111.183 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -70.42 142.44 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.496 HG21 HD12 ' A' ' 162' ' ' ILE . 85.8 t -92.48 111.88 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.588 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 155.29 38.09 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 121.435 0.636 . . . . 0.0 111.49 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.403 HG13 ' HD3' ' A' ' 216' ' ' PRO . 41.5 t -71.37 120.41 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.2 -12.37 33.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.261 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.778 0.323 . . . . 0.0 110.859 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.502 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.1 m-20 -69.93 110.65 5.14 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.487 HD21 HG13 ' A' ' 175' ' ' VAL . 70.2 mt -97.28 148.89 22.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.783 0.801 . . . . 0.0 113.088 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 209' ' ' GLN . 52.6 mt -114.16 113.18 43.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.5 mp -93.34 137.51 32.58 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.0 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.5 t -129.19 126.85 64.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.61 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.2 t -66.09 127.72 33.25 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 99.5 t -71.22 -32.12 46.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.979 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -80.13 -35.69 36.34 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.5 m -116.94 4.79 12.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.42 31.8 1.39 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -113.58 141.05 47.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.019 0.437 . . . . 0.0 110.759 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 48.5 m-85 -71.5 153.71 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.41 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.23 75.61 2.36 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.08 150.36 38.88 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -174.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.3 tp -100.28 116.53 32.47 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 113.667 -1.606 . . . . 0.0 107.632 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.416 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 47.5 t -110.16 146.79 34.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -105.26 94.56 5.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.7 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.86 -169.51 33.81 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.961 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.9 p30 -11.54 -66.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.425 0.69 . . . . 0.0 112.714 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 53.1 m -154.62 11.92 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.193 0.52 . . . . 0.0 109.731 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 69.4 m -127.04 -178.69 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.851 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.62 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.64 135.69 48.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.167 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.7 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 10.9 m80 -128.32 172.99 10.55 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.004 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.9 p -127.2 134.32 66.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.297 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.9 p30 -151.7 172.03 16.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.594 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.86 93.84 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.209 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.04 174.09 6.07 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.191 -177.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -83.08 9.35 10.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.01 135.54 54.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.678 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.51 ' NE2' HD13 ' A' ' 182' ' ' ILE . 92.4 mt-30 -65.61 175.56 1.8 Allowed 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.284 1.04 . . . . 0.0 113.028 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.9 m -168.73 122.32 0.85 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.144 -1.844 . . . . 0.0 107.936 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 55.1 mt -76.42 127.43 32.83 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.082 0.468 . . . . 0.0 109.969 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.4 m95 -114.81 146.98 40.43 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.682 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.9 t -114.15 100.8 8.65 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.163 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.745 HG22 ' HG ' ' A' ' 22' ' ' LEU . 78.4 t -92.6 102.02 13.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.74 141.04 25.43 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.113 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.418 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.86 103.41 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.129 1.886 . . . . 0.0 111.266 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.554 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 . . . . . 0 CA--C 1.519 -0.237 0 CA-C-O 120.778 0.323 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 22.2 mt -80.18 122.63 27.07 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 11.2 mmm180 -111.63 157.84 19.95 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.059 0.457 . . . . 0.0 111.215 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.44 ' HG1' ' N ' ' A' ' 111' ' ' ARG . 11.6 p -68.36 155.32 40.04 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.868 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.94 -8.37 1.29 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.639 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.7 m-20 -69.07 135.03 50.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 12.7 tt0 -80.24 119.03 22.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.53 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.1 m -135.08 171.9 16.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.676 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.05 140.89 45.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.658 -1.156 . . . . 0.0 108.473 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.765 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -101.52 121.1 41.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.689 0.281 . . . . 0.0 110.5 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -121.58 152.59 39.08 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.536 0.684 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' HD22 ' A' ' 194' ' ' LEU . 24.3 t -139.05 143.99 38.61 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.741 179.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.3 m -86.33 121.28 28.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.39 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.589 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.16 119.92 39.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.001 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.6 m -124.86 137.04 54.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.944 0.402 . . . . 0.0 111.582 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.7 tt -173.08 143.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.54 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.8 m80 58.91 37.41 24.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.877 0.37 . . . . 0.0 110.713 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.88 25.63 15.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.105 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -127.07 122.59 34.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.468 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -114.98 145.18 42.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.332 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.447 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.8 pt20 -157.63 171.15 20.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.563 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -118.56 134.83 54.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.59 178.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.6 mt -124.47 142.47 51.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.341 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 54.0 t -107.09 141.3 38.54 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.644 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 tp -61.01 113.22 2.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.992 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.458 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.15 164.74 12.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.271 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.35 162.32 10.32 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.694 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -133.18 146.7 51.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.831 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.89 3.34 85.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.788 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -114.08 152.18 31.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 110.972 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.02 -140.45 23.13 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.725 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.0 4.69 11.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.621 0.248 . . . . 0.0 111.147 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.25 31.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.158 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.3 mt -77.67 139.72 39.48 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.466 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.0 m -79.58 149.7 31.3 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.564 0.697 . . . . 0.0 111.284 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -145.18 -166.21 2.37 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.555 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.6 mt -130.47 145.21 51.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.438 0.637 . . . . 0.0 112.301 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.503 -0.851 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.769 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.596 HD11 HG11 ' A' ' 21' ' ' VAL . 47.3 tp . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -49.6 -48.14 49.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.458 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.6 pt -72.67 -17.88 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 111.467 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.676 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.69 -0.67 45.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.118 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.486 HG22 ' OG ' ' A' ' 124' ' ' SER . 28.3 m -86.2 132.77 33.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.208 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -137.4 163.08 31.92 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.889 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.544 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.6 t -126.14 133.6 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.719 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.47 HD11 HG11 ' A' ' 20' ' ' VAL . 15.9 mt -82.58 64.35 7.18 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.1 mm-40 -43.7 -61.32 1.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -178.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 60.9 mm-40 -125.36 164.53 20.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 112.893 -177.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -156.64 85.08 0.97 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.893 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mt -114.9 155.44 26.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.279 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.3 p -68.6 148.52 50.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.2 t -50.03 -44.16 21.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.161 0.505 . . . . 0.0 110.235 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.0 ttp85 -57.91 -51.2 70.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.236 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.84 -43.06 99.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.706 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.83 -47.11 87.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.988 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 179.93 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.814 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 8.2 mm-40 . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.882 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 18.9 pttp -86.53 -50.53 6.78 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 120.349 1.431 . . . . 0.0 111.611 -2.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.484 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.6 t-105 -56.55 -39.24 73.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.293 -1.321 . . . . 0.0 113.135 -177.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 51.6 tttp -61.39 -33.75 74.19 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.287 -179.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.814 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 24.5 t80 -73.93 -44.8 53.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.899 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 17.6 tpt -59.37 -39.17 82.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.65 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 53.1 ttp -71.0 -47.37 59.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.849 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -59.06 -45.01 91.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.1 m -66.98 -46.96 73.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.108 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.88 72.15 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.189 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.753 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.44 ' N ' ' HG1' ' A' ' 16' ' ' THR . 15.6 ptm180 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.955 0.407 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 91.2 m -79.33 145.34 33.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.33 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.54 132.25 35.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.802 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -116.31 142.46 46.81 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.202 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -62.56 129.82 42.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.083 0.468 . . . . 0.0 110.473 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.56 -12.21 58.14 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.56 140.42 32.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.971 0.415 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.98 128.31 33.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.0 pt -112.42 158.62 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 112.747 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.1 tp -114.44 108.98 17.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.88 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.0 mt -97.35 115.6 28.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.691 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.544 ' NH2' HG21 ' A' ' 68' ' ' VAL . 64.9 ttp85 -102.22 116.42 32.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.712 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.471 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.6 t-80 -58.09 108.69 0.63 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.486 ' OG ' HG22 ' A' ' 66' ' ' THR . 67.6 m -50.3 -53.3 29.58 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.471 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.8 t80 -56.82 -69.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -63.96 -31.96 73.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 89.24 -0.54 81.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.959 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.9 mtt -83.73 -165.82 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.432 -0.21 . . . . 0.0 110.432 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.49 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.3 m-85 -133.66 138.38 45.86 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 24.8 tp -54.07 125.96 20.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 47.6 t -135.13 149.93 50.1 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 40.8 t -96.69 97.12 9.1 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.7 mt -74.0 155.93 38.08 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.483 -178.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.3 m -84.93 2.37 43.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.856 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 48.0 p -89.16 124.55 34.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.692 0.282 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.514 -0.434 0 CA-C-O 121.414 0.626 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.3 m-85 -101.9 174.28 6.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.93 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -93.65 142.55 27.22 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.54 118.68 58.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.97 5.91 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.713 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 54.3 mt -115.07 146.73 41.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.074 0.464 . . . . 0.0 110.67 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -138.72 139.72 38.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.848 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.81 -78.56 0.07 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.692 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.21 146.91 46.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.645 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 120' ' ' LEU . 74.1 p -105.13 5.42 32.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.267 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.9 p -58.35 111.69 1.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.668 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.53 -163.35 19.53 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.937 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.481 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 30.8 mt-10 -116.35 -8.81 11.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.774 0.321 . . . . 0.0 111.261 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.84 -32.13 67.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.5 p -93.41 10.27 32.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.11 131.71 54.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.1 0.476 . . . . 0.0 111.479 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.438 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.6 m95 -126.63 116.76 21.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.912 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.9 p -78.62 127.09 31.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.167 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.467 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.86 135.02 26.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.947 0.403 . . . . 0.0 110.953 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.429 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 66.6 m-70 -127.26 149.88 70.9 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.217 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.636 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.41 138.07 49.23 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.522 2.148 . . . . 0.0 112.216 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.21 -40.3 52.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.565 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.2 p -108.63 -171.75 1.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.489 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -91.78 -8.0 47.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.203 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -71.42 -34.25 70.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.211 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 71.3 mmt-85 -89.99 146.3 24.47 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.708 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 40.8 t -129.19 168.18 16.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.976 0.417 . . . . 0.0 111.383 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.7 136.16 55.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.96 -17.3 51.85 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.293 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 170' ' ' SER . 24.1 mt-10 -67.3 155.99 37.52 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.919 0.39 . . . . 0.0 111.396 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.4 mttt -71.84 144.17 49.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.477 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.467 HG21 HD12 ' A' ' 162' ' ' ILE . 92.8 t -94.89 112.81 28.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.316 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -77.7 155.17 31.46 Favored 'General case' 0 CA--C 1.5 -0.964 0 CA-C-O 121.392 0.615 . . . . 0.0 111.471 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.413 HG13 ' HD3' ' A' ' 216' ' ' PRO . 53.0 t -69.2 121.82 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.72 -17.15 33.33 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.291 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -63.27 127.02 29.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.738 0.304 . . . . 0.0 110.824 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.6 m-20 -69.88 112.89 6.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -98.19 149.01 23.01 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.517 HD13 ' NE2' ' A' ' 209' ' ' GLN . 48.6 mt -113.56 113.23 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.5 136.17 33.44 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.257 0.551 . . . . 0.0 112.354 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.442 HG22 ' CD1' ' A' ' 191' ' ' TYR . 70.8 t -129.03 125.25 62.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.545 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 45.4 t -64.5 126.55 28.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.77 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.481 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -69.77 -33.93 58.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.991 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.36 -36.32 39.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 56.3 m -116.3 5.45 13.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.07 31.26 1.53 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 31.4 mtt85 -112.04 142.67 44.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.899 0.38 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.9 m-85 -74.29 153.56 39.31 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -75.86 76.82 2.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 175.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.405 ' HA ' ' OG1' ' A' ' 210' ' ' THR . 82.0 t60 -76.44 149.32 36.86 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 -174.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.569 HD22 ' SG ' ' A' ' 24' ' ' CYS . 11.4 tp -100.33 114.64 28.3 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.634 177.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.406 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 41.6 t -107.17 147.33 30.23 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -106.45 91.39 3.68 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.668 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -76.14 -174.19 37.13 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.496 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 80.3 m-20 -5.6 -75.87 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.243 0.617 . . . . 0.0 112.457 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 35.8 t -146.32 14.4 1.27 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.097 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 59.3 m -128.33 -179.83 5.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.996 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.589 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.4 m95 -107.89 135.48 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.23 0.538 . . . . 0.0 111.243 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.668 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 11.5 m80 -128.2 174.92 8.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.881 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.7 p -129.29 133.16 66.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.35 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.77 173.07 14.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.669 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.37 96.24 7.58 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.71 -179.5 3.67 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -88.44 10.72 19.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.424 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -118.99 134.88 54.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.058 0.456 . . . . 0.0 110.72 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.517 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.8 mt-30 -61.31 175.09 0.6 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.364 1.078 . . . . 0.0 112.844 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 210' ' ' THR . . . . . 0.41 HG23 ' SG ' ' A' ' 24' ' ' CYS . 22.8 m -168.65 119.35 0.76 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 112.979 -1.918 . . . . 0.0 107.782 178.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.7 mt -74.19 128.89 36.71 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.024 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.4 m95 -116.12 146.31 42.34 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.466 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -113.78 100.55 8.54 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.304 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.765 HG22 ' HG ' ' A' ' 22' ' ' LEU . 95.6 t -92.88 100.55 11.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.19 141.8 26.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.074 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.413 ' HD3' HG13 ' A' ' 177' ' ' VAL . 26.8 Cg_exo -62.42 103.88 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.192 1.928 . . . . 0.0 111.265 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.53 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.311 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 . . . . . 0 CA--C 1.516 -0.354 0 CA-C-O 120.723 0.297 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.92 129.58 38.18 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.3 mmt85 -117.4 157.38 26.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.098 0.475 . . . . 0.0 111.103 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 9.1 p -67.95 155.08 40.25 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.726 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.07 -7.8 1.43 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.699 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.9 m-20 -69.33 133.05 47.37 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.836 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.32 121.16 25.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.495 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 22.1 m -136.07 173.0 14.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.61 HG11 HD11 ' A' ' 62' ' ' LEU . 3.1 m -134.93 136.74 51.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.169 176.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -98.06 124.86 42.77 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.655 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 71.9 mt-30 -124.91 145.01 50.03 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 121.664 0.745 . . . . 0.0 112.295 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.7 p -131.42 146.11 52.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.882 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -88.16 123.49 32.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.627 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.37 120.03 38.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.304 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.8 m -125.17 136.51 53.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.934 0.397 . . . . 0.0 111.685 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.0 tt -173.8 143.64 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.564 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 49.0 m80 61.15 32.63 19.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.734 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mmmm 67.74 22.31 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.075 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -126.06 124.61 41.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.511 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -116.16 147.28 41.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.208 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -158.21 172.98 17.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -120.4 136.02 54.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -125.3 145.28 50.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.391 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 28.9 p -107.42 140.09 40.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.08 0.467 . . . . 0.0 110.622 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -62.75 111.62 2.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.072 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.69 166.05 11.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.461 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.2 163.09 15.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.31 149.94 46.14 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.66 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.1 -5.25 89.32 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.755 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -107.39 157.35 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 0.0 110.938 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -141.57 23.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.368 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -83.34 9.54 10.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.683 0.278 . . . . 0.0 110.705 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.28 29.78 0.25 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.124 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -80.01 139.41 36.99 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.819 0.342 . . . . 0.0 110.512 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 31.5 p -78.71 148.15 33.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.364 0.602 . . . . 0.0 111.031 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -141.25 -165.57 1.99 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.001 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 29.7 mt -131.97 146.22 51.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.293 0.568 . . . . 0.0 112.374 -178.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 3.8 mt-10 . . . . . 0 CA--C 1.5 -0.952 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.718 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.61 HD11 HG11 ' A' ' 21' ' ' VAL . 49.2 tp . . . . . 0 C--O 1.232 0.137 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.4 m -50.94 -44.31 60.37 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 38' ' ' ALA . 23.3 pt -73.07 -20.67 18.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 56.4 m -97.54 12.75 32.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.948 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.6 m -91.31 128.29 37.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.145 0.498 . . . . 0.0 111.729 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -136.09 161.53 35.45 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.129 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.589 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -125.46 132.43 71.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.5 mt -80.71 66.56 6.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 16.3 mm-40 -45.68 -64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.439 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 57.5 mm-40 -122.12 163.08 20.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.705 0.764 . . . . 0.0 112.826 -177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.3 m -154.69 85.9 1.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.427 -1.26 . . . . 0.0 108.771 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.9 158.09 20.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.538 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.9 p -70.49 146.49 50.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 50.7 t -48.63 -44.25 14.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.099 0.476 . . . . 0.0 110.539 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -57.98 -53.11 61.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.3 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -43.3 96.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.769 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.4 tp -62.03 -47.54 84.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.306 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 51.9 mt-30 . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 120.728 0.299 . . . . 0.0 110.741 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.695 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 119.233 -0.413 . . . . 0.0 110.715 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.695 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 84.9 mttt -89.84 -56.02 3.4 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-O 123.229 1.49 . . . . 0.0 108.547 -5.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 101' ' ' MET . 76.4 m95 -77.06 -27.44 54.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 112.661 -2.063 . . . . 0.0 111.66 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -56.05 -58.76 6.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.895 -178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.586 ' HB3' ' HG3' ' A' ' 96' ' ' GLU . 2.5 t80 -77.26 -33.46 55.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.838 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.469 ' HB3' ' HA ' ' A' ' 98' ' ' TRP . 1.8 tmt? -56.31 -49.52 74.07 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.395 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.8 mtm -74.66 -43.41 55.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -57.15 -43.63 82.67 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.829 0.347 . . . . 0.0 110.963 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.9 m -72.58 -46.78 52.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.31 -34.46 66.54 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.366 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.003 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 20.1 ptp180 . . . . . 0 CA--C 1.526 0.042 0 CA-C-O 121.036 0.445 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.404 HG21 ' HG2' ' A' ' 174' ' ' LYS . 86.2 m -79.93 145.27 32.73 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.105 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.29 131.19 35.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.659 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -115.34 142.7 46.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.199 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -62.81 134.44 56.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.053 0.454 . . . . 0.0 110.5 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.06 -14.4 63.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.986 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -81.53 141.1 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.085 0.469 . . . . 0.0 111.361 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.72 128.41 34.34 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.156 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -113.11 160.43 12.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.638 0.732 . . . . 0.0 112.73 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.439 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.2 tp -116.52 108.82 16.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.94 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.3 mt -96.62 116.45 29.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.675 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.589 ' NH2' HG21 ' A' ' 68' ' ' VAL . 55.1 ttp85 -102.49 116.95 33.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.749 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.445 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.5 t-80 -59.2 107.6 0.57 Allowed 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 177.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 35.1 t -48.47 -54.78 12.95 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.445 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.1 t80 -56.82 -70.05 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.415 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.6 p -63.18 -28.81 70.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 86.83 -5.44 84.98 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.92 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.0 mtt -80.18 -165.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.446 0.165 . . . . 0.0 110.703 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.46 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.3 m-85 -134.02 140.21 46.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.36 126.25 24.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.0 t -135.18 148.28 49.64 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.1 t -94.83 97.92 10.38 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.32 147.37 40.21 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.0 t -78.34 2.35 18.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.587 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 40.5 p -87.97 121.67 30.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.578 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 121.534 0.683 . . . . 0.0 112.835 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -102.69 174.26 5.97 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.963 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -93.32 141.78 28.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.861 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 60.9 t -111.31 125.97 68.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -144.15 -150.69 5.3 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.757 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 66.5 mt -114.62 144.55 43.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.149 0.5 . . . . 0.0 110.969 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -137.29 137.95 39.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.677 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.45 -76.15 0.08 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.48 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -63.89 146.46 53.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.7 p -103.33 -0.66 29.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.035 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.8 p -54.97 112.26 1.01 Allowed 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.411 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 130.12 -161.55 23.08 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.52 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -118.68 -15.25 9.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 0.0 111.493 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.25 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.1 m -88.05 5.45 40.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.62 0.248 . . . . 0.0 111.613 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -110.88 132.69 53.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.103 0.478 . . . . 0.0 111.261 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.458 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.5 m95 -127.34 117.77 22.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.704 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.404 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 11.2 p -79.26 126.46 30.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.111 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.498 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.5 135.13 26.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.932 0.396 . . . . 0.0 110.976 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.436 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.2 m-70 -127.71 151.65 75.71 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.209 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.728 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.7 Cg_endo -68.07 140.31 49.36 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.519 2.146 . . . . 0.0 112.454 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.12 -47.27 52.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.843 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.458 ' HB3' ' NE2' ' A' ' 168' ' ' GLN . 62.2 m -111.82 -170.96 1.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.238 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.2 15.24 12.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.093 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.458 ' NE2' ' HB3' ' A' ' 166' ' ' SER . 2.4 mp0 -86.75 -35.18 19.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.21 0.529 . . . . 0.0 110.367 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -94.54 153.74 17.74 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.176 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.3 m -133.93 166.86 21.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.885 0.374 . . . . 0.0 111.342 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.03 132.2 48.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.524 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.39 -16.35 60.11 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.2 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -68.73 157.97 35.23 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.003 0.43 . . . . 0.0 111.158 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.404 ' HG2' HG21 ' A' ' 112' ' ' THR . 38.9 mttp -74.12 143.13 45.47 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.498 HG21 HD12 ' A' ' 162' ' ' ILE . 99.5 t -93.17 115.05 31.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.265 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.7 mpt_? -78.93 155.01 29.2 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-O 121.298 0.571 . . . . 0.0 111.615 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 39.0 t -69.42 121.13 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.47 -11.95 36.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.374 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -68.2 127.62 33.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.764 0.316 . . . . 0.0 110.731 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -69.7 110.36 4.85 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.489 HD21 HG13 ' A' ' 175' ' ' VAL . 71.2 mt -96.37 148.54 22.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.757 0.789 . . . . 0.0 113.127 -178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.436 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 54.5 mt -113.53 112.86 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -92.82 138.26 31.64 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.157 0.504 . . . . 0.0 112.052 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 191' ' ' TYR . 77.9 t -130.33 120.45 48.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.001 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 99.9 p -61.04 123.01 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.626 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 89.3 t -66.59 -33.19 61.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -76.04 -39.96 54.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.475 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 49.7 m -113.95 5.37 16.14 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.91 29.86 1.79 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 34.8 mtt85 -110.34 143.21 40.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.899 0.381 . . . . 0.0 110.838 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 56.5 m-85 -74.53 153.83 38.9 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.406 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.4 tp -75.68 76.22 2.67 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 105.322 -2.103 . . . . 0.0 105.322 175.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.1 t60 -76.4 151.79 36.46 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -174.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.7 tp -101.12 116.21 32.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 113.604 -1.635 . . . . 0.0 107.537 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.405 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 46.8 p -109.0 146.95 33.06 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -177.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -105.77 91.08 3.6 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.614 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.32 -174.17 40.62 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.329 -0.938 . . . . 0.0 111.594 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.53 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.7 m120 -3.09 -76.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.341 0.656 . . . . 0.0 112.496 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.0 p -147.39 14.3 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.064 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.2 t -128.12 -179.7 5.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.627 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -107.36 135.22 49.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.265 0.555 . . . . 0.0 111.294 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.614 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 12.4 m80 -127.93 176.79 7.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.01 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 203' ' ' VAL . . . . . 0.587 HG13 ' SG ' ' A' ' 47' ' ' CYS . 2.7 p -131.47 131.51 62.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.337 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.93 173.93 12.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.552 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.92 96.1 7.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.86 -179.51 3.65 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.252 -177.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -87.97 7.21 32.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.415 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 39.3 mt-30 -115.39 136.21 53.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.452 . . . . 0.0 110.687 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.42 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.7 mt-30 -64.57 174.68 1.65 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.371 1.081 . . . . 0.0 112.695 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -166.61 119.38 1.02 Allowed 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.093 -1.867 . . . . 0.0 107.826 178.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 47.7 mt -73.16 128.82 36.58 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.514 -0.474 . . . . 0.0 109.948 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.435 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.3 m95 -116.2 145.05 43.41 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.596 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.8 t -112.02 100.49 8.91 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.3 t -92.52 100.66 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.75 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 215' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.25 27.73 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.087 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 215' ' ' ALA . 25.5 Cg_exo -63.53 104.33 0.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.071 1.847 . . . . 0.0 111.029 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.495 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 5.7 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.368 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.4 mt -78.16 124.37 27.98 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.8 mmm180 -111.49 158.03 19.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.982 0.42 . . . . 0.0 111.087 -179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 p -68.09 155.23 40.01 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.889 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.1 -7.3 1.34 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.676 -179.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.2 m-20 -68.3 136.16 53.03 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.064 0.459 . . . . 0.0 110.974 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 13.5 tt0 -82.81 119.53 24.48 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.557 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.5 m -136.29 173.12 14.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.668 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.63 139.48 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.278 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.746 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -99.97 120.56 39.99 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.672 0.272 . . . . 0.0 110.67 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -123.07 142.14 51.2 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.454 0.645 . . . . 0.0 112.185 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 194' ' ' LEU . 19.6 t -127.92 146.66 50.57 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.866 178.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.0 m -87.98 122.34 31.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.267 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.613 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.76 122.64 47.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.347 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.2 m -125.68 140.21 52.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.447 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 tt -175.48 139.45 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.761 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.8 m80 57.86 43.19 21.99 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 60.27 23.73 13.14 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.296 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -126.52 123.13 37.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.607 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -117.53 151.25 37.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.195 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -163.36 172.7 14.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.79 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -118.98 138.09 53.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.583 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -129.1 139.1 52.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.311 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.579 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 45.3 t -102.09 145.85 28.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.879 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -66.9 116.83 8.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.755 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.44 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . . . -116.48 162.44 17.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.591 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.22 165.56 21.87 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.753 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.58 144.49 39.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.569 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.91 51.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.436 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -123.24 147.59 46.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.847 0.356 . . . . 0.0 110.639 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.12 -139.81 21.58 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.411 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.85 4.66 13.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.72 0.295 . . . . 0.0 110.779 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.48 32.42 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.908 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.6 139.97 39.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.032 0.444 . . . . 0.0 110.472 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.6 m -79.73 151.14 30.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.556 0.693 . . . . 0.0 111.347 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -147.05 -167.85 2.89 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.622 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.7 mt -131.0 145.67 52.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 112.321 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 46.5 mt-10 . . . . . 0 CA--C 1.494 -1.192 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.921 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 21' ' ' VAL . 57.4 tp . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.523 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.2 t -51.58 -52.7 45.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.68 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 38' ' ' ALA . 37.9 pt -71.57 -14.46 17.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.668 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.53 -3.26 46.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.428 0.632 . . . . 0.0 110.059 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.492 HG22 ' OG ' ' A' ' 124' ' ' SER . 37.7 m -84.77 134.11 34.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.123 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -137.66 162.13 34.65 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.782 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.582 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -125.62 133.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.733 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 mt -82.32 63.77 6.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.5 mm-40 -43.7 -61.03 1.53 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -178.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.402 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 60.2 mm-40 -124.97 163.93 21.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.708 0.766 . . . . 0.0 112.977 -177.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.32 84.38 0.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.363 -1.29 . . . . 0.0 108.995 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.45 154.83 25.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.367 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.4 p -67.88 147.12 52.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.428 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.7 t -49.44 -44.99 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.088 0.47 . . . . 0.0 110.354 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -56.65 -54.21 48.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.227 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.77 97.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.9 tp -59.78 -49.3 78.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.065 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 96.7 mt-30 . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.755 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.787 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.3 mm-40 . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.787 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -87.06 -50.77 6.42 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-N 120.45 1.477 . . . . 0.0 111.624 -2.721 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.635 ' H ' ' HG2' ' A' ' 97' ' ' LYS . 4.7 m-90 -66.24 -28.68 68.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.941 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.685 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -61.17 -39.47 90.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.174 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.737 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 36.3 t80 -74.28 -42.24 59.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.785 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.6 tpt -56.64 -49.42 75.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.932 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.2 mtm -71.54 -38.04 71.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -57.56 -45.76 84.75 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.859 0.361 . . . . 0.0 110.512 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.7 p -72.96 -39.28 66.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.701 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.02 69.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.074 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 179.898 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 . . . . . 0 CA--C 1.527 0.064 0 CA-C-O 121.073 0.463 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.408 HG21 ' HG2' ' A' ' 174' ' ' LYS . 93.3 m -75.76 148.09 38.77 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.052 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -81.34 131.63 35.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.837 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 77.9 mt -116.03 141.55 47.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.218 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -61.56 130.71 47.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.458 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.31 -12.7 60.15 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.037 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.99 141.53 32.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.12 0.485 . . . . 0.0 111.27 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.58 127.77 33.67 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.4 pt -112.77 159.42 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.556 0.693 . . . . 0.0 112.746 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.402 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.07 109.7 18.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.864 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.9 mt -97.4 116.97 30.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.629 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.582 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.4 ttp85 -103.4 116.01 31.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.777 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.5 t-80 -58.27 108.16 0.58 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 177.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.492 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -51.72 -48.33 63.64 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.523 ' HD1' ' HG ' ' A' ' 63' ' ' SER . 68.7 t80 -61.21 -64.63 0.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.439 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -72.12 -19.87 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.9 -0.19 73.06 Favored Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.236 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.6 mtt -83.32 -165.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.411 0.148 . . . . 0.0 110.636 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.478 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.2 m-85 -133.75 138.53 45.81 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.401 HD13 HD21 ' A' ' 37' ' ' LEU . 22.1 tp -55.39 127.4 29.35 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 177.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.586 ' SG ' HD21 ' A' ' 133' ' ' LEU . 20.5 p -137.02 150.01 47.83 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.0 t -95.36 99.53 11.45 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.589 -1.264 . . . . 0.0 107.589 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.586 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.2 mt -75.45 152.74 37.89 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.888 -178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.6 p -78.53 -5.71 53.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.81 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 31.1 p -85.32 124.16 31.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.729 0.299 . . . . 0.0 110.884 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 51.6 m . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.308 0.575 . . . . 0.0 111.948 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.506 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.0 m-85 -101.23 172.46 6.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.029 177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.06 142.93 27.23 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 62.9 t -111.48 117.52 55.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.383 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.35 -150.28 5.99 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.082 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.6 mt -115.14 146.36 41.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.036 0.446 . . . . 0.0 111.029 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.482 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 7.2 tp60 -137.62 143.65 41.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.705 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.37 -50.75 12.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -81.82 143.25 31.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 77.6 p -106.49 -6.66 17.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 110.978 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 66.8 p -54.84 114.23 1.64 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.46 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.28 -158.15 21.51 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.462 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.469 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.4 mt-10 -121.11 -12.48 8.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.765 0.317 . . . . 0.0 111.357 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.57 -32.15 68.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.122 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 79.7 m -90.86 6.2 45.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.718 0.295 . . . . 0.0 111.593 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -110.07 134.07 52.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.015 0.436 . . . . 0.0 111.365 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.474 ' O ' HG12 ' A' ' 119' ' ' ILE . 51.7 m95 -128.02 117.41 21.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.611 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.429 HG23 HG22 ' A' ' 186' ' ' VAL . 13.5 p -78.84 125.89 29.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.057 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.48 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.13 136.17 23.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.919 0.39 . . . . 0.0 110.89 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.42 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 74.6 m-70 -128.23 150.17 73.29 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.662 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.5 Cg_endo -66.16 137.58 48.51 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.377 2.051 . . . . 0.0 112.407 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.51 -40.93 41.13 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.289 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 58.6 m -103.49 -173.55 2.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.406 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 167' ' ' LYS . 14.0 tmtt? -95.22 -2.12 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.931 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.09 -33.31 44.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.035 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.662 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 58.7 mmt-85 -86.88 144.86 26.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.606 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 48.8 m -127.23 167.93 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.327 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.7 134.21 51.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.1 59.5 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.285 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -67.93 156.98 36.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.408 ' HG2' HG21 ' A' ' 112' ' ' THR . 63.3 mttt -73.56 141.68 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.366 178.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 162' ' ' ILE . 97.4 t -91.82 113.64 27.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.358 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -78.43 154.79 30.34 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.337 0.589 . . . . 0.0 111.57 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 48.0 t -69.96 122.16 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.322 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.26 -11.55 36.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.07 127.71 33.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.891 0.376 . . . . 0.0 110.935 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.439 ' HA ' ' O ' ' A' ' 212' ' ' TRP . 6.8 m-20 -69.82 114.02 7.61 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 175' ' ' VAL . 70.1 mt -99.78 149.5 23.29 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.481 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.9 mt -114.3 112.3 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -92.24 138.12 31.79 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.063 0.459 . . . . 0.0 112.048 -178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.474 HG22 ' CD1' ' A' ' 191' ' ' TYR . 80.0 t -130.48 127.99 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.709 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.8 m -64.59 123.16 18.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.469 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.2 t -67.44 -30.26 48.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.832 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.9 t -79.13 -38.38 36.22 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.461 ' HB2' HH11 ' A' ' 190' ' ' ARG . 94.2 p -120.52 10.61 11.17 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 45.29 33.07 1.12 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 39.1 mtt85 -109.01 138.39 45.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.961 0.41 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.5 m-85 -72.2 153.06 41.83 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.404 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.4 tp -75.28 75.5 2.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 175.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -74.15 151.12 40.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -174.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.2 tp -101.53 115.8 31.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.721 -1.582 . . . . 0.0 107.645 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.4 p -109.28 145.83 35.3 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -105.7 92.45 4.18 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.594 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.73 -174.3 46.39 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.266 -0.968 . . . . 0.0 111.368 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 39.6 m-80 -1.14 -78.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.298 0.639 . . . . 0.0 112.52 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.6 p -146.68 12.87 1.16 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.07 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 49.9 m -126.74 -178.45 4.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.613 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.0 m95 -108.53 135.47 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.281 0.563 . . . . 0.0 111.328 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.594 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 14.9 m80 -127.66 175.33 8.37 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.064 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.23 133.69 63.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.443 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.7 172.15 16.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.605 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -98.77 95.99 7.59 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.93 179.18 4.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.325 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -87.21 8.16 25.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.835 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.456 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 37.2 mt-30 -114.16 134.98 54.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.721 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.481 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.4 mt-30 -64.05 174.32 1.58 Allowed 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.296 1.046 . . . . 0.0 112.742 -178.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 210' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.2 m -167.85 121.6 0.94 Allowed 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 113.102 -1.863 . . . . 0.0 107.912 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.422 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 41.1 mt -76.37 130.31 37.88 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.122 0.487 . . . . 0.0 109.885 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.439 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.1 m95 -117.54 147.58 42.66 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.705 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -114.02 99.19 7.46 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.377 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.746 HG22 ' HG ' ' A' ' 22' ' ' LEU . 94.8 t -91.85 100.78 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.759 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.83 140.69 25.76 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.092 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 19' ' ' GLU . 27.9 Cg_exo -62.1 104.69 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.079 1.853 . . . . 0.0 111.251 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.557 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.235 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-O 120.755 0.312 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.7 mt -81.96 120.5 25.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 15' ' ' ARG . 7.8 mmm180 -109.12 158.65 17.58 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.99 0.424 . . . . 0.0 111.035 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 p -67.75 157.22 35.19 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.793 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 69.03 -2.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.877 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -74.25 134.36 42.66 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.468 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -79.68 119.37 22.52 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.533 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.9 m -136.88 169.64 19.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.663 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -132.22 140.28 48.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 108.398 176.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.769 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.22 122.01 42.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.691 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 42.9 mt-30 -122.15 151.77 40.62 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.527 0.679 . . . . 0.0 111.889 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.1 p -137.57 140.8 41.23 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.808 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -83.26 122.82 28.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.157 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.622 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.81 120.96 40.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.4 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.3 m -125.66 140.15 52.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.428 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.1 tt -175.71 143.13 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.642 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.1 m80 58.09 39.23 26.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.749 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.25 26.22 15.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.049 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -129.26 122.84 30.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.575 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -116.02 149.15 39.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -161.16 174.15 14.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.67 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 18.5 mtpp -120.98 135.19 55.27 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.504 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.2 mt -125.18 142.33 51.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.568 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 43.8 t -106.44 142.97 35.23 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.894 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.479 HD21 HD13 ' A' ' 130' ' ' LEU . 27.0 tp -63.49 115.61 4.81 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.795 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.19 164.69 14.11 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.683 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.82 165.47 9.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.683 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.93 144.64 39.15 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.627 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -82.26 17.55 17.83 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.662 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -126.75 151.95 47.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 0.0 110.446 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.15 -135.86 15.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.262 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 8.1 p30 -85.56 8.12 20.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.706 0.289 . . . . 0.0 110.78 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.0 29.23 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.922 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.11 142.25 38.21 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 120.974 0.416 . . . . 0.0 110.55 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.62 151.4 25.34 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.512 0.672 . . . . 0.0 111.098 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 64' ' ' ILE . 21.9 p90 -144.9 -167.58 2.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.763 -1.108 . . . . 0.0 108.555 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.36 142.6 50.1 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.402 -0.519 . . . . 0.0 112.305 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 48.1 mt-10 . . . . . 0 CA--C 1.495 -1.147 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.158 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.504 HD11 HG11 ' A' ' 21' ' ' VAL . 50.5 tp . . . . . 0 C--O 1.231 0.097 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.463 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.4 t -50.07 -51.09 45.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.744 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.408 HD12 ' CZ ' ' A' ' 48' ' ' PHE . 33.2 pt -72.05 -15.97 18.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.887 0.375 . . . . 0.0 111.593 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.663 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.97 -1.52 45.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.339 0.59 . . . . 0.0 110.307 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.494 HG22 ' OG ' ' A' ' 124' ' ' SER . 34.0 m -85.92 135.65 33.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.022 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.16 161.88 36.32 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -125.73 132.88 70.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.65 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.419 HD23 ' CD2' ' A' ' 121' ' ' LEU . 15.4 mt -82.01 66.93 7.8 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.2 mm-40 -46.28 -62.5 1.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.405 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.2 mm100 -121.67 165.72 15.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.667 0.746 . . . . 0.0 112.963 -177.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -158.93 82.72 0.79 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.9 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -111.37 156.55 21.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.413 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.0 t -69.77 147.15 50.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.22 -45.33 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.477 . . . . 0.0 110.254 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 ttp85 -55.5 -54.72 40.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.295 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.41 -45.17 94.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.015 -179.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.0 tp -59.93 -46.54 89.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.394 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 120.928 0.394 . . . . 0.0 110.772 -179.987 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.77 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.6 mm-40 . . . . . 0 CA--C 1.534 0.341 0 CA-C-O 118.861 -0.59 . . . . 0.0 112.224 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.7 ptmt -86.55 -44.15 12.15 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.971 1.308 . . . . 0.0 110.826 -3.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -53.35 -49.42 67.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.219 -1.355 . . . . 0.0 112.731 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.527 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 55.3 mtpt -55.48 -30.59 60.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.667 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.77 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.2 t80 -73.81 -48.23 32.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.026 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.09 -42.51 85.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.11 -39.43 72.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.653 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -60.61 -39.91 89.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.542 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.6 m -72.39 -49.16 35.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.256 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.98 78.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.495 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.015 -179.811 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 121.022 0.439 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.5 m -75.81 148.38 38.46 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.027 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -81.74 129.58 34.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -114.92 143.13 45.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.252 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -62.57 133.23 54.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.024 0.44 . . . . 0.0 110.471 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.7 -11.64 64.59 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.048 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.441 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.09 139.74 32.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.982 0.42 . . . . 0.0 111.356 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.42 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.26 128.71 34.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.8 pt -113.39 159.22 13.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.547 0.689 . . . . 0.0 112.792 -178.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.405 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.0 tp -115.4 108.39 16.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.858 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.419 ' CD2' HD23 ' A' ' 69' ' ' LEU . 48.3 mt -95.76 118.11 31.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.665 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 19.7 ttp180 -103.75 115.36 30.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.669 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.494 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.1 t-80 -57.44 109.5 0.7 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.494 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -52.75 -48.81 66.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.494 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 77.4 t80 -61.6 -62.5 1.76 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.443 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.7 p -73.26 -20.74 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.81 -1.23 74.46 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.084 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.3 mtt -83.37 -165.92 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 60.0 m-85 -133.03 139.06 47.02 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.479 HD13 HD21 ' A' ' 37' ' ' LEU . 24.2 tp -54.42 129.53 36.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.4 t -138.81 147.32 42.39 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.6 t -94.04 98.05 10.74 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -73.74 156.83 37.46 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.559 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.0 m -81.61 -10.38 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.432 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -87.13 123.75 32.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.711 0.291 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 57.9 m . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.564 0 CA-C-O 121.326 0.584 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 15.7 m-85 -103.17 169.43 8.56 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.928 178.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -88.26 144.09 26.64 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 99.1 t -113.51 116.09 51.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.463 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.72 -147.89 5.76 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.323 -0.941 . . . . 0.0 112.695 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 70.2 mt -116.3 153.49 31.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.828 0.346 . . . . 0.0 110.618 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -143.62 139.21 29.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.81 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.96 -69.24 0.36 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.473 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.75 143.77 51.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.589 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' THR . . . . . 0.401 HG21 HD21 ' A' ' 120' ' ' LEU . 52.3 p -103.15 1.32 33.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.349 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -56.23 115.12 2.27 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.56 -161.89 18.9 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.613 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.487 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 33.8 mt-10 -117.07 -11.25 10.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.815 0.341 . . . . 0.0 111.273 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.71 67.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 83.8 m -92.22 9.45 33.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.22 132.5 54.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.099 0.476 . . . . 0.0 111.361 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.4 m95 -127.45 117.15 21.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.597 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 7.4 p -79.06 128.14 32.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.267 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.528 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -89.48 133.41 31.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 111.052 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.464 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.4 m-70 -126.57 150.15 69.99 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.2 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.702 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.3 Cg_endo -67.54 137.52 42.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.519 2.146 . . . . 0.0 112.065 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.29 -43.42 56.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.688 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 54.9 m -106.88 -174.04 2.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.039 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.63 8.06 40.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.157 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -83.83 -34.67 24.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.853 -179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.702 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -90.02 148.23 23.19 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.531 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 51.1 m -128.13 167.15 17.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.98 135.76 55.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 89.29 -16.88 54.85 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.395 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 23.8 mt-10 -67.41 154.97 40.13 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.924 0.393 . . . . 0.0 111.161 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -71.87 142.15 49.56 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 178.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.528 HG21 HD12 ' A' ' 162' ' ' ILE . 92.5 t -91.53 113.03 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.755 0.312 . . . . 0.0 110.412 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -75.51 152.96 37.75 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.34 0.591 . . . . 0.0 111.5 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.444 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.6 t -68.94 121.43 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.661 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.69 -11.9 35.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.342 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.36 130.34 42.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.831 0.348 . . . . 0.0 110.905 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 13.2 m-20 -71.95 112.18 7.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 76.5 mt -98.13 150.07 21.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.521 HD13 ' NE2' ' A' ' 209' ' ' GLN . 51.4 mt -114.32 112.89 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -92.75 136.28 33.38 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.191 0.52 . . . . 0.0 112.129 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.453 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.7 t -128.74 126.27 64.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.862 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 5.3 m -63.93 125.47 24.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -70.63 -32.05 48.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.682 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.7 t -81.21 -36.31 30.23 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 53.1 m -114.98 5.51 15.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 45.22 33.16 1.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -116.09 142.47 46.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.989 0.424 . . . . 0.0 110.772 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.8 m-85 -72.6 153.84 41.06 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 27.3 tp -75.31 76.45 2.41 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 175.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -75.54 150.74 38.05 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -174.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -101.59 114.39 28.39 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.705 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.419 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 48.2 t -107.88 146.24 32.6 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -177.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -106.41 91.2 3.6 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.02 -179.73 52.98 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.032 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 35.1 m-80 7.65 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.23 0.612 . . . . 0.0 112.386 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 49.7 m -142.19 5.71 1.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.349 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.1 m -120.89 -179.31 3.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.206 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.622 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.6 m95 -106.27 139.3 40.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.274 0.559 . . . . 0.0 111.198 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.518 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 18.8 m80 -130.26 172.08 12.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.962 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.88 132.6 69.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.295 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.419 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.8 p30 -150.31 170.19 19.6 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.588 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.49 93.77 6.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.307 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.07 175.8 5.29 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.268 -177.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.02 10.66 9.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.195 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 14.0 mm100 -117.6 136.5 53.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.684 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.521 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.3 mt-30 -64.56 175.61 1.35 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.434 1.111 . . . . 0.0 113.151 -178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.7 m -169.49 120.07 0.68 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 112.919 -1.946 . . . . 0.0 107.721 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 31.6 mt -74.76 128.91 36.71 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.923 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.35 144.88 43.1 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.566 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.9 t -112.44 101.18 9.37 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.428 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.769 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.6 t -92.68 100.48 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.779 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -111.46 142.15 25.92 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.446 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.1 Cg_exo -63.68 103.73 0.41 Allowed 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.209 1.939 . . . . 0.0 111.365 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.533 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.926 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.6 mt -80.73 122.59 27.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.4 mmm180 -109.75 157.29 19.29 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 111.182 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.409 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.1 p -67.82 156.45 37.07 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.763 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.74 -9.9 1.03 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.69 -179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.9 m-20 -67.72 134.09 50.45 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -79.8 120.41 24.03 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.471 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.7 m -136.35 172.99 14.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -135.16 139.23 47.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.304 176.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.779 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.2 mp -100.04 122.62 43.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.529 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -123.04 146.02 48.03 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.625 0.726 . . . . 0.0 112.223 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -131.38 142.56 50.07 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.752 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.7 m -84.25 120.95 26.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.322 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.588 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.99 117.51 31.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.216 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.1 m -122.02 137.02 54.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.023 0.44 . . . . 0.0 111.731 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -171.89 144.8 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.496 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.3 m80 60.19 34.84 21.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt 64.19 25.43 13.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.133 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -128.37 126.66 41.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.177 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -116.26 141.86 47.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 111.571 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -151.59 174.39 13.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.633 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -122.28 135.54 54.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.645 178.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -124.62 141.58 51.99 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.523 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.3 t -104.76 142.34 34.89 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.684 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.49 ' HA ' HD23 ' A' ' 49' ' ' LEU . 35.7 tp -60.93 112.93 2.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.684 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.426 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.73 163.4 14.19 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.515 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.73 160.21 10.39 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.405 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.7 141.85 48.78 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.622 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.414 ' HA2' ' CE ' ' A' ' 128' ' ' MET . . . -81.82 16.36 21.11 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.193 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -122.13 148.52 44.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 0.0 110.714 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.58 -138.39 20.24 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.583 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -81.54 8.83 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.644 0.259 . . . . 0.0 110.971 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.08 31.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.249 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.9 mt -78.31 138.65 38.69 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 110.556 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.3 m -79.86 151.47 30.19 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.631 0.729 . . . . 0.0 111.413 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.71 -161.9 1.42 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.558 -1.201 . . . . 0.0 108.348 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.5 mt -132.89 145.36 50.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.0 112.066 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.4 tt0 . . . . . 0 CA--C 1.503 -0.847 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.526 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.623 HD11 HG11 ' A' ' 21' ' ' VAL . 44.8 tp . . . . . 0 CA--C 1.527 0.09 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.3 p -46.83 -51.87 15.56 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.426 HD12 ' HB1' ' A' ' 38' ' ' ALA . 32.1 pt -71.38 -17.32 19.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.19 -1.33 42.35 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.937 0.399 . . . . 0.0 111.452 -179.233 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.487 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.1 m -84.66 132.9 34.42 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -137.07 162.91 32.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.971 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -126.27 133.92 67.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 HG11 ' A' ' 20' ' ' VAL . 18.4 mt -82.64 66.55 8.3 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.483 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.7 mm-40 -45.5 -64.62 0.69 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.453 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 55.9 mm-40 -122.98 165.26 17.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.773 0.797 . . . . 0.0 113.033 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.8 m -156.11 86.12 1.03 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.114 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.5 mt -112.96 157.09 21.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.514 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.7 t -69.65 146.86 51.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.9 t -50.36 -45.73 25.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.12 0.486 . . . . 0.0 110.236 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -57.18 -51.57 68.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.218 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -44.63 96.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.789 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.72 -46.75 89.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.263 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 . . . . . 0 C--N 1.325 -0.472 0 CA-C-O 120.925 0.393 . . . . 0.0 110.569 179.935 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.713 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.916 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 89.9 mttt -89.38 -57.61 2.82 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 123.068 1.414 . . . . 0.0 108.843 -5.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -77.8 -27.39 50.11 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 112.873 -1.967 . . . . 0.0 111.655 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.0 -59.2 5.41 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.249 -0.58 . . . . 0.0 111.068 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.555 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.5 t80 -77.33 -36.01 54.27 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.919 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.4 ttt -57.26 -38.53 74.01 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.082 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.5 ttt -76.64 -42.8 40.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -57.0 -42.43 80.26 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.844 0.354 . . . . 0.0 110.249 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -72.52 -44.37 62.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.655 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.35 -31.84 66.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.83 179.652 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 121.054 0.454 . . . . 0.0 111.625 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.3 m -77.45 147.35 35.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.17 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.42 130.84 35.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 84.2 mt -114.98 142.35 46.75 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.226 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -63.17 132.37 51.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.977 0.418 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.47 -15.64 59.79 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.979 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -80.51 141.63 34.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.102 0.477 . . . . 0.0 111.568 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.02 127.32 33.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.132 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.0 pt -112.01 162.82 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.492 0.663 . . . . 0.0 112.761 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.453 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.9 tp -118.73 109.99 16.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.949 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -98.0 117.77 33.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.615 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.483 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.7 ttp-105 -104.08 116.15 31.7 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.438 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.2 t-80 -58.11 109.06 0.68 Allowed 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.487 ' OG ' HG22 ' A' ' 66' ' ' THR . 69.9 m -50.07 -54.13 22.43 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.438 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 46.7 t80 -57.54 -69.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.411 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.5 p -62.76 -29.39 70.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.73 -1.82 88.01 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.085 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' MET . . . . . 0.414 ' CE ' ' HA2' ' A' ' 41' ' ' GLY . 64.1 mtm -85.29 -165.69 1.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.193 . . . . 0.0 110.575 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 59.0 m-85 -132.27 140.07 48.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.463 HD13 HD21 ' A' ' 37' ' ' LEU . 24.7 tp -55.03 128.46 33.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 177.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.8 t -137.97 147.7 44.51 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -176.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -94.58 97.98 10.5 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.502 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.2 mt -74.71 155.45 37.69 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.341 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -85.72 3.97 38.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.928 -178.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 64.2 p -92.2 123.72 35.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.649 0.262 . . . . 0.0 110.977 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.682 179.966 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . . . . . . 0 N--CA 1.449 -0.489 0 CA-C-O 121.493 0.664 . . . . 0.0 112.236 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 18.8 m-85 -101.81 173.03 6.59 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.963 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -90.98 141.99 28.25 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.7 117.68 55.71 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.346 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.84 -150.66 6.13 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.769 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 72.3 mt -114.39 148.43 37.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.902 0.382 . . . . 0.0 110.618 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -135.22 141.58 45.83 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.39 -58.7 3.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.71 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -82.64 151.69 26.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.883 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.7 p -107.33 -3.19 19.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.162 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.8 p -56.71 113.02 1.46 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.14 -159.02 22.23 Favored Glycine 0 N--CA 1.442 -0.965 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.517 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 42.1 mt-10 -120.63 -12.54 8.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.781 0.324 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.87 -32.24 67.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.214 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.0 m -92.17 9.1 35.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -111.69 131.45 55.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.147 0.498 . . . . 0.0 111.408 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -126.47 117.52 23.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.775 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -79.07 126.4 30.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.101 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.466 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -88.56 135.17 26.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.855 0.359 . . . . 0.0 111.009 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.486 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 74.5 m-70 -127.25 151.58 74.8 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.149 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.5 Cg_endo -67.6 138.83 46.76 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.554 2.169 . . . . 0.0 112.275 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.72 -42.38 41.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.447 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 36.4 m -105.01 -173.09 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.416 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -95.41 6.92 47.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.475 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -86.23 -34.26 20.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.947 0.403 . . . . 0.0 110.792 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.4 mmp_? -86.78 146.52 26.21 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 33.9 t -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.429 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.84 129.08 38.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.253 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.24 -13.61 64.44 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.999 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.8 158.47 36.03 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.943 0.401 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -74.09 143.16 45.51 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.466 HG21 HD12 ' A' ' 162' ' ' ILE . 89.8 t -93.48 114.93 31.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.264 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -80.74 155.0 26.93 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 121.325 0.583 . . . . 0.0 111.709 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.84 122.82 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.54 -18.0 27.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.922 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -66.88 128.79 37.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.746 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.457 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.3 m-20 -72.99 116.54 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.429 HD21 HG13 ' A' ' 175' ' ' VAL . 61.7 mt -99.73 149.43 23.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.486 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 56.2 mt -114.31 112.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 176.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.71 137.61 32.21 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.177 0.513 . . . . 0.0 112.278 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.443 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.7 t -130.41 124.21 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.841 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 32.2 t -63.06 127.46 31.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 97.7 t -71.39 -32.26 46.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 120.896 0.379 . . . . 0.0 110.814 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.1 p -78.91 -39.42 34.87 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.477 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 55.1 m -114.06 4.91 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.32 31.15 1.7 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.301 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.32 144.18 42.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.93 0.395 . . . . 0.0 110.69 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.474 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.8 m-85 -74.15 152.57 39.81 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 41.3 tp -75.15 77.6 2.3 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -77.75 150.44 34.38 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -174.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.8 tp -100.1 119.16 37.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.532 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.3 t -113.01 147.19 37.69 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.55 90.17 3.25 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.581 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.09 -175.03 46.32 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.17 -1.014 . . . . 0.0 111.437 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 34.8 m-80 1.11 -78.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.368 0.667 . . . . 0.0 112.496 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 34.6 t -147.05 11.38 1.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 52.2 m -125.88 -178.97 4.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.982 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.588 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.2 135.6 48.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.21 0.528 . . . . 0.0 111.195 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.581 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 18.1 m80 -127.23 174.73 8.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.79 130.07 66.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.283 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -147.05 172.31 13.93 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.606 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.26 92.31 5.38 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.61 179.64 4.02 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.562 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -88.11 11.38 16.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.298 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -119.6 137.65 53.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.697 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.31 175.58 1.28 Allowed 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 122.352 1.072 . . . . 0.0 112.997 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.8 m -169.36 119.84 0.69 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.794 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 39.6 mt -74.36 129.41 37.74 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.045 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.412 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.9 m95 -116.04 146.77 41.9 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.449 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -115.02 101.89 9.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.318 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.779 HG22 ' HG ' ' A' ' 22' ' ' LEU . 61.9 t -93.49 101.58 12.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.975 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 215' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.0 143.23 29.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.098 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.38 105.26 0.59 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.237 1.958 . . . . 0.0 111.366 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.471 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.94 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.8 mt -80.11 122.47 26.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 178.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.2 mmm180 -111.71 158.05 19.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.186 0.517 . . . . 0.0 111.315 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -68.06 155.79 38.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.7 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 16' ' ' THR . 7.5 m-20 71.18 -3.46 2.06 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.841 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.431 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.7 m-20 -72.74 138.35 46.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -84.74 119.39 25.22 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.5 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -135.83 170.54 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -177.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.564 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.66 135.91 58.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.267 176.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.777 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -97.04 123.06 40.67 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.519 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.457 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 38.2 mt-30 -120.2 164.83 15.63 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.275 0.56 . . . . 0.0 111.355 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -151.82 142.88 23.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.49 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -86.99 119.73 27.5 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.43 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.11 119.84 39.23 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.851 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.7 m -123.88 132.01 53.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 112.037 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.528 HG23 ' CD2' ' A' ' 29' ' ' HIS . 17.7 tt -168.9 148.94 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.446 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.528 ' CD2' HG23 ' A' ' 28' ' ' ILE . 47.7 m-70 58.23 42.0 22.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 59.82 23.21 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.28 179.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -126.5 145.68 50.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.412 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -130.71 142.52 50.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.924 0.392 . . . . 0.0 111.2 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.492 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -153.9 171.55 18.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.853 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 34' ' ' LYS . 17.3 mtpp -120.39 138.18 53.9 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.419 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.492 HD21 ' OE1' ' A' ' 33' ' ' GLN . 1.5 mt -127.14 145.43 50.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.21 137.62 46.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.987 0.423 . . . . 0.0 110.549 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.555 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -60.83 111.69 1.75 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.168 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.438 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.56 165.54 11.73 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.417 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.89 162.02 11.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.802 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.57 148.09 50.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.7 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.9 -0.57 89.77 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.737 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -112.22 158.02 20.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.841 0.353 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.36 -136.15 16.18 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.464 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.435 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 1.2 p30 -87.12 7.86 26.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.695 0.283 . . . . 0.0 110.877 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.87 28.84 0.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.323 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.8 mt -79.41 141.13 37.13 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.2 m -80.93 150.04 29.15 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.476 0.655 . . . . 0.0 111.245 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -144.14 -168.72 2.95 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.743 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.555 HD23 ' HA ' ' A' ' 37' ' ' LEU . 22.7 mt -130.94 144.53 51.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.422 0.63 . . . . 0.0 112.361 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.2 mt-10 . . . . . 0 CA--C 1.503 -0.854 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.819 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.564 HD11 HG11 ' A' ' 21' ' ' VAL . 50.1 tp . . . . . 0 C--O 1.232 0.153 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.3 m -52.32 -46.52 66.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -70.92 -20.34 21.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 57.1 m -97.71 13.02 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.072 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.505 HG22 ' OG ' ' A' ' 124' ' ' SER . 25.8 m -91.36 130.37 37.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.15 0.5 . . . . 0.0 111.91 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.06 161.53 35.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.108 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.66 133.34 69.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.609 178.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.1 mt -81.49 65.5 6.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.8 mm-40 -44.55 -60.23 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.406 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 58.2 mm-40 -126.42 163.67 22.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.706 0.765 . . . . 0.0 112.839 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.6 t -155.43 84.06 1.05 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.476 -1.238 . . . . 0.0 108.999 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -111.73 152.65 27.52 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.33 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.4 t -65.4 148.55 51.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -50.44 -46.09 26.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.027 0.441 . . . . 0.0 110.288 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -55.55 -57.56 11.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.129 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.35 -44.76 84.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.177 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.8 -50.88 72.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.104 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.629 179.901 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.782 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 31.8 mm-40 . . . . . 0 CA--C 1.533 0.317 0 CA-C-O 118.735 -0.65 . . . . 0.0 112.37 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.723 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 26.1 ttmt -86.64 -50.6 6.68 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.363 1.465 . . . . 0.0 111.487 -2.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 51.6 t-105 -54.86 -36.68 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.319 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 88.0 tttt -65.75 -32.82 74.58 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.771 -178.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.782 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -74.1 -49.37 24.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.999 0.428 . . . . 0.0 109.885 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 53.7 ttp -61.06 -37.94 84.42 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.763 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttp -73.41 -40.19 64.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.983 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -61.34 -45.21 95.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.788 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 48.9 p -70.85 -45.27 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.292 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.88 -31.08 72.05 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.257 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.973 -179.709 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 19.2 ptp180 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 121.041 0.448 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.479 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 75.0 m -78.45 147.02 34.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.286 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.0 131.55 35.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.679 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 75.2 mt -115.29 143.39 45.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.046 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -62.79 132.68 53.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.041 0.448 . . . . 0.0 110.554 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.91 -11.84 64.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.039 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.93 141.42 32.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.038 0.447 . . . . 0.0 111.267 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.87 127.42 33.48 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 49.0 pt -111.41 161.87 9.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.565 0.698 . . . . 0.0 112.692 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 24.0 tp -117.74 108.25 15.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.809 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 54.7 mt -96.37 116.85 29.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.832 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.493 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 13.4 ttp-105 -102.94 116.26 32.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.671 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.2 t-80 -58.44 108.32 0.61 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.505 ' OG ' HG22 ' A' ' 66' ' ' THR . 58.6 m -49.71 -53.09 26.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.434 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.3 t80 -58.57 -69.7 0.18 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -64.99 -23.75 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.27 -1.92 83.5 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.309 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.2 mtt -81.56 -164.65 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.503 0.192 . . . . 0.0 110.644 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.9 m-85 -134.77 137.87 43.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.04 129.2 29.99 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -138.26 147.6 43.85 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.7 t -94.98 96.45 9.29 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.498 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.6 mt -71.44 156.66 39.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.574 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 45.7 t -83.13 -7.31 59.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.189 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 72.5 p -88.63 121.14 30.69 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.854 0.359 . . . . 0.0 111.23 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.559 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 28.6 t . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.617 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.514 -0.438 0 CA-C-O 121.528 0.68 . . . . 0.0 112.158 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 18.5 m-85 -100.01 171.01 8.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.04 177.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -89.37 144.05 26.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 76.6 t -113.4 117.07 54.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.0 -147.19 5.6 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.307 -0.949 . . . . 0.0 113.006 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.7 mt -117.34 147.74 42.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.94 0.4 . . . . 0.0 111.074 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -136.05 142.95 44.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.742 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -75.4 -55.77 5.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.783 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.43 145.82 30.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 0.0 110.882 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.3 p -103.59 -8.04 20.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.994 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 69.0 p -55.09 109.95 0.6 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.408 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.65 -158.36 23.21 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.42 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -122.13 -13.39 8.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.704 0.288 . . . . 0.0 111.124 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.13 67.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.094 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.9 m -91.96 8.3 38.16 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.43 132.39 54.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.106 0.479 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.74 117.89 22.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.63 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.434 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 16.0 p -78.99 125.8 29.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.172 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.478 HD12 HG21 ' A' ' 175' ' ' VAL . 3.4 pt -87.83 136.45 23.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.851 0.357 . . . . 0.0 110.676 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.489 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 84.7 m-70 -129.04 150.21 74.71 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.644 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.0 Cg_endo -67.17 138.72 48.14 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.205 . . . . 0.0 112.287 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.23 66.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 63.1 m -112.82 -167.78 1.23 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.176 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -91.59 -13.35 32.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.903 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.03 -35.71 81.13 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.997 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 75.9 mmt-85 -91.31 143.87 26.19 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 56.0 m -124.82 166.4 16.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.414 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 171' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.84 131.21 45.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.545 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.41 -14.88 64.27 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.082 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -68.77 154.71 41.48 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.947 0.403 . . . . 0.0 111.043 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -70.55 142.89 51.74 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.478 HG21 HD12 ' A' ' 162' ' ' ILE . 93.3 t -93.03 110.92 23.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.498 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 153.23 40.14 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 121.289 0.566 . . . . 0.0 111.363 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 16.5 t -69.66 120.88 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 176.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.25 -13.75 30.96 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.304 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -67.58 132.28 47.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.321 . . . . 0.0 111.001 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.1 m-20 -73.1 116.17 13.3 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.421 HD21 HG13 ' A' ' 175' ' ' VAL . 60.7 mt -101.43 148.83 24.71 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.676 0.751 . . . . 0.0 112.964 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.532 HD13 ' NE2' ' A' ' 209' ' ' GLN . 51.9 mt -113.53 113.81 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 176.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -93.6 137.28 33.03 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.112 0.482 . . . . 0.0 112.224 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.438 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.5 t -130.52 125.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.793 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.6 t -63.88 125.62 24.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.853 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 98.6 t -70.14 -30.81 45.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.88 0.372 . . . . 0.0 110.711 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.2 t -81.6 -33.78 31.32 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 69.9 m -120.77 10.16 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.498 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.3 31.19 0.36 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.498 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 27.4 mtt85 -112.2 142.66 44.41 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.089 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.475 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 58.8 m-85 -73.76 152.41 40.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 36.9 tp -74.76 75.99 2.08 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.64 149.47 38.18 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -174.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.54 116.46 31.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.753 -1.567 . . . . 0.0 107.768 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 51.7 p -110.05 146.26 35.67 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -105.68 92.67 4.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.548 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -80.82 -174.84 49.03 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.435 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.1 m-80 0.66 -79.37 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.283 0.633 . . . . 0.0 112.409 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.8 p -146.61 12.2 1.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.98 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.7 p -125.94 -179.45 4.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.1 m95 -106.85 136.45 46.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.18 0.514 . . . . 0.0 111.196 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.548 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 16.8 m80 -128.66 173.01 10.68 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.009 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.02 136.43 60.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.231 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -154.0 172.24 17.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.572 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.476 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -99.15 95.2 6.93 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.095 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.72 -179.4 3.63 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.321 -177.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -88.67 8.59 27.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.178 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 47.2 mt-30 -116.02 138.19 51.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.769 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.532 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.3 mt-30 -66.62 175.63 2.26 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.319 1.057 . . . . 0.0 113.242 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.0 m -170.04 121.3 0.65 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.954 -1.93 . . . . 0.0 107.67 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 46.2 mt -74.68 131.42 40.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.798 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.3 m95 -118.89 127.48 53.53 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.344 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.5 t -93.16 101.45 13.74 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.318 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.777 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.9 t -93.86 102.5 13.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.663 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.18 142.03 27.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.335 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.28 103.93 0.39 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.14 1.893 . . . . 0.0 111.098 178.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.5 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.3 mm . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.299 -179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 . . . . . 0 CA--C 1.517 -0.29 0 CA-C-O 120.778 0.323 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.7 mt -79.95 122.91 27.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -110.67 157.23 19.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.105 0.479 . . . . 0.0 111.257 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 7.4 p -67.64 157.19 35.07 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.828 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 69.16 -2.2 1.89 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.793 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -73.95 139.81 45.13 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.443 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 16.8 tt0 -84.0 118.13 23.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.463 HG11 HD11 ' A' ' 69' ' ' LEU . 17.3 m -135.52 169.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.659 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -131.96 141.0 46.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 108.388 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.76 120.82 40.66 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.571 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -122.19 148.58 44.77 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.698 0.761 . . . . 0.0 112.323 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.514 ' SG ' HD22 ' A' ' 194' ' ' LEU . 27.1 t -136.45 147.45 47.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.492 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.0 m -88.99 123.49 33.36 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.552 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.665 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.42 120.86 41.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.094 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 m -126.51 133.32 51.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.766 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.522 HG23 ' CD2' ' A' ' 29' ' ' HIS . 18.4 tt -170.4 148.59 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.499 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 28' ' ' ILE . 48.4 m-70 58.4 40.26 24.42 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.908 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.05 22.16 12.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.594 179.492 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -126.21 145.75 50.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.456 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -131.12 149.02 52.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.905 0.383 . . . . 0.0 111.196 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -161.6 169.58 21.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -116.42 138.22 51.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.526 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.6 mt -128.06 139.44 52.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.705 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 48.0 t -104.61 142.63 34.31 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.632 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.3 tp -62.27 114.85 3.71 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.751 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.67 165.04 13.22 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.5 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.56 166.27 10.1 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.715 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.59 145.75 38.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.616 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.16 17.34 33.43 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.198 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -123.44 150.27 44.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.852 0.358 . . . . 0.0 110.621 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.18 -135.8 15.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.493 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 6.4 p30 -85.12 8.7 17.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.689 0.28 . . . . 0.0 111.083 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.465 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.52 29.24 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.293 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -77.26 139.33 39.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.019 0.438 . . . . 0.0 110.546 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.3 m -81.12 151.18 28.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.593 0.711 . . . . 0.0 111.119 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -144.85 -165.65 2.21 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.61 178.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.8 mt -130.64 140.7 50.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.386 0.613 . . . . 0.0 112.083 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.504 -0.802 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.59 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.631 HD11 HG11 ' A' ' 21' ' ' VAL . 45.5 tp . . . . . 0 C--O 1.231 0.113 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.2 m -46.72 -55.76 7.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 26.9 pt -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.659 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.48 -3.27 43.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 0.0 111.262 -179.363 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.8 m -83.72 134.55 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.271 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.87 164.85 27.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.02 133.64 65.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.817 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.463 HD11 HG11 ' A' ' 20' ' ' VAL . 14.7 mt -82.85 65.01 7.76 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.3 mm-40 -44.55 -59.66 2.35 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.416 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.5 mm-40 -125.93 164.19 21.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.682 0.753 . . . . 0.0 112.897 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -156.18 84.77 1.0 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.993 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.0 mt -111.84 157.92 20.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.457 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -71.64 147.87 47.09 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.6 t -49.55 -44.12 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.095 0.474 . . . . 0.0 110.247 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -58.83 -50.08 75.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.98 97.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.828 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.81 -44.19 96.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.157 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 120.884 0.373 . . . . 0.0 110.462 179.805 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.79 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 20.9 mm-40 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.816 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.759 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 32.3 mtmm -86.61 -51.11 6.35 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 120.251 1.387 . . . . 0.0 111.326 -2.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -55.87 -40.52 73.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.847 -1.524 . . . . 0.0 112.881 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 20.8 tptm -58.18 -34.42 70.33 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.206 -179.192 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.79 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.0 t80 -73.44 -44.73 57.53 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 15.9 tpt -57.77 -34.37 69.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.216 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.5 mtp -73.22 -49.86 25.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -59.84 -34.69 73.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.646 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.9 m -72.65 -46.86 51.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.913 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.67 71.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.744 179.709 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.429 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 13.3 ptp180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.974 0.416 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 174' ' ' LYS . 88.8 m -70.8 148.16 48.17 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.094 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 mp -82.19 131.33 35.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.514 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 74.5 mt -116.37 141.85 47.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.387 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.36 131.86 51.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.495 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.21 -10.37 61.62 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.178 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -85.83 140.24 30.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.072 0.463 . . . . 0.0 111.365 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.88 127.53 33.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.3 pt -111.91 161.77 10.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.521 0.677 . . . . 0.0 112.732 -178.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.416 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.7 tp -117.49 109.31 16.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.885 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.404 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.2 mt -96.67 118.11 32.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.768 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.467 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.6 ttp-105 -104.28 116.46 32.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.454 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.453 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.8 t-80 -58.82 107.44 0.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.3 t -49.79 -49.95 46.63 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -177.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 51.8 t80 -61.09 -67.25 0.42 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.423 ' OG ' HD13 ' A' ' 149' ' ' LEU . 56.0 p -68.22 -20.38 64.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.396 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.97 -0.85 71.02 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.252 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -82.67 -164.62 0.88 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.8 m-85 -133.95 138.26 45.36 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.6 tp -54.05 127.89 28.36 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 177.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.8 t -136.69 149.86 48.14 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -97.52 99.09 10.48 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.536 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 11.8 mt -75.9 153.5 36.66 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 54.4 m -84.01 9.95 11.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.954 -178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.2 p -94.03 124.81 38.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.84 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.394 0 CA-C-O 121.386 0.612 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.536 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.0 m-85 -100.17 170.38 8.5 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.276 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -89.26 144.3 26.2 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -113.63 117.6 55.9 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.348 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.5 -147.08 5.52 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.899 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 59.0 mt -117.42 151.28 37.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.893 0.378 . . . . 0.0 110.774 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -141.69 142.97 33.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.886 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.54 -64.11 1.1 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.566 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -73.46 145.11 45.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.664 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 60.2 p -104.05 -5.13 22.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.947 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.3 p -54.71 111.84 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.527 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.84 -160.56 22.84 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.485 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.432 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -118.53 -12.29 9.81 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.803 0.335 . . . . 0.0 111.234 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.49 66.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 77.9 m -94.55 10.86 33.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -111.8 131.64 55.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.57 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.0 m95 -127.22 116.64 20.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.662 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 8.0 p -79.25 128.6 33.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.188 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.492 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.81 135.59 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 0.0 110.842 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 66.9 m-70 -127.8 150.23 72.74 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.186 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.715 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.91 137.08 43.72 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.504 2.136 . . . . 0.0 112.297 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.01 -45.79 59.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.752 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.432 ' HB2' ' NE2' ' A' ' 168' ' ' GLN . 85.3 p -108.53 -175.59 2.82 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.262 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.74 14.83 14.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.139 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.432 ' NE2' ' HB2' ' A' ' 166' ' ' SER . 2.6 mp0 -88.21 -33.06 18.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.715 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.4 mmp_? -92.46 146.76 23.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.069 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 32.0 t -125.1 165.76 17.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.278 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.8 OUTLIER -65.83 131.63 46.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.488 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 172' ' ' GLY . . . . . 0.402 ' O ' HD22 ' A' ' 114' ' ' LEU . . . 93.95 -16.43 60.91 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.049 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.1 mt-10 -67.49 155.08 39.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.042 0.448 . . . . 0.0 111.205 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 112' ' ' THR . 73.8 mttt -71.16 142.68 50.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.602 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.492 HG21 HD12 ' A' ' 162' ' ' ILE . 95.4 t -93.74 112.0 25.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.148 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ARG . . . . . 0.441 ' HD2' ' N ' ' A' ' 176' ' ' ARG . 1.2 mpt_? -78.58 154.83 30.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-O 121.388 0.614 . . . . 0.0 111.611 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 55.2 t -69.05 122.72 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.25 -12.69 36.93 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.076 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.26 126.29 29.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.787 0.327 . . . . 0.0 110.796 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.449 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 18.9 m-20 -69.49 114.77 8.03 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.476 HD21 HG13 ' A' ' 175' ' ' VAL . 60.4 mt -100.44 151.84 21.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.788 0.804 . . . . 0.0 112.998 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.484 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.2 mt -115.75 113.74 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 9.8 mp -93.48 135.32 34.84 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.201 0.525 . . . . 0.0 112.189 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.1 t -127.35 126.66 68.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.739 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.4 t -67.03 124.18 22.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.432 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 98.4 t -68.64 -32.72 56.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.946 0.403 . . . . 0.0 110.968 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.2 t -78.0 -37.62 46.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 p -117.63 7.76 12.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 46.34 31.95 1.4 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.49 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 36.1 mtt85 -112.42 142.3 45.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.842 0.353 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 63.6 m-85 -74.31 154.04 39.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.4 tp -76.09 76.95 2.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.404 -2.072 . . . . 0.0 105.404 175.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.403 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.3 t60 -76.89 150.23 36.03 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.514 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.4 tp -99.84 115.88 30.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 113.763 -1.562 . . . . 0.0 107.656 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 68.3 m -109.65 145.66 36.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -103.4 96.98 7.11 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 177.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.744 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -76.73 -167.03 25.67 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.04 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.461 ' C ' ' O ' ' A' ' 197' ' ' GLY . 3.3 p30 -18.92 -63.03 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.3 p -154.7 11.59 0.37 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.217 0.532 . . . . 0.0 109.612 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.1 t -127.04 179.02 5.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.832 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.665 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.5 m95 -106.24 135.76 47.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.297 0.57 . . . . 0.0 111.27 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.744 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 9.6 m80 -128.45 174.02 9.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.863 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -128.14 132.43 68.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.308 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -149.82 168.0 24.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.662 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.498 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.7 96.79 9.63 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.75 179.45 3.95 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.386 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -87.2 8.41 24.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.186 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.403 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 16.5 mm-40 -117.23 136.68 52.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.724 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.484 ' NE2' HD13 ' A' ' 182' ' ' ILE . 88.7 mt-30 -65.23 174.7 1.94 Allowed 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 122.364 1.078 . . . . 0.0 113.007 -178.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.7 m -166.71 121.54 1.11 Allowed 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.99 -1.914 . . . . 0.0 107.798 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 51.2 mt -75.23 128.74 36.14 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.035 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.2 m95 -116.27 145.32 43.24 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.611 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 39.2 t -113.04 101.29 9.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.278 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 92.5 t -92.61 102.19 13.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.918 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 215' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.36 27.89 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.475 ' O ' HG12 ' A' ' 217' ' ' ILE . 22.8 Cg_exo -64.8 105.26 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.252 1.968 . . . . 0.0 111.484 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.49 HG23 HD21 ' A' ' 62' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.833 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 . . . . . 0 CA--C 1.517 -0.312 0 CA-C-O 120.898 0.38 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.4 mt -78.55 124.35 28.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -112.1 157.47 20.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.07 0.462 . . . . 0.0 110.952 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.2 p -67.64 155.38 39.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.863 179.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 71.02 -3.36 2.05 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.874 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -72.58 134.7 45.32 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.51 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -80.58 119.39 23.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.574 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.6 m -136.18 171.14 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.625 0.726 . . . . 0.0 112.948 -177.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.691 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.8 m -133.73 137.15 53.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.271 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.767 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.1 mp -97.73 121.77 40.04 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.613 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.46 ' HB2' ' OG ' ' A' ' 213' ' ' SER . 80.3 mt-30 -121.34 156.0 33.54 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.352 0.596 . . . . 0.0 111.538 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.529 ' SG ' HD22 ' A' ' 194' ' ' LEU . 21.5 t -143.7 144.48 31.88 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.368 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -86.14 124.98 33.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.445 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.36 119.53 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.034 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.2 m -122.46 139.38 53.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.781 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.2 tt -178.38 144.55 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.671 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.1 m80 59.11 41.15 21.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.318 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.3 20.98 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.626 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -127.81 134.28 49.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 110.672 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -124.02 146.22 48.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.056 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -156.21 171.62 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.857 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -117.87 136.37 53.5 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.464 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.07 143.02 51.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.44 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.612 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 50.9 t -107.64 142.67 37.24 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.649 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.3 tp -62.35 114.51 3.53 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.72 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.422 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -114.48 164.28 14.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.434 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 166.79 10.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.686 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.23 151.26 47.5 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.687 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.12 -6.92 87.66 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.624 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -107.82 163.07 13.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.11 -142.03 25.82 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.401 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.2 p30 -84.09 9.68 11.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 110.622 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.61 29.28 0.4 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.949 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.4 mt -79.37 139.17 37.82 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.97 0.414 . . . . 0.0 110.621 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.6 m -80.25 149.84 30.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.545 0.688 . . . . 0.0 111.131 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -144.17 -166.97 2.49 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.591 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.4 mt -129.79 141.43 50.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.336 0.588 . . . . 0.0 112.266 -178.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 mt-10 . . . . . 0 CA--C 1.502 -0.87 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.755 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.534 HD11 HG11 ' A' ' 21' ' ' VAL . 44.6 tp . . . . . 0 C--O 1.232 0.149 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.9 m -47.62 -54.88 10.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.422 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.0 pt -68.54 -16.9 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.691 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.01 -0.39 47.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.075 0.464 . . . . 0.0 111.305 -179.183 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.3 m -85.27 134.12 34.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.349 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -138.27 162.5 34.18 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.101 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.581 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.8 134.57 65.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.71 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 121' ' ' LEU . 16.4 mt -83.25 64.93 8.01 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.51 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.8 mm-40 -44.25 -62.9 1.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.408 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 56.7 mm-40 -122.91 163.08 21.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.705 0.764 . . . . 0.0 112.897 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -155.34 85.08 1.06 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.478 -1.237 . . . . 0.0 108.951 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.33 158.14 20.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.8 p -71.13 146.83 48.95 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -49.92 -45.72 22.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.083 0.468 . . . . 0.0 110.195 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.2 ttp85 -55.44 -54.24 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.454 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.31 95.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.821 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.4 tp -59.06 -44.55 91.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.281 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.893 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.809 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 3.2 mm-40 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.789 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.809 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 54.0 pttt -87.5 -50.98 6.18 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 120.372 1.442 . . . . 0.0 111.691 -3.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.413 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.7 p-90 -63.99 -28.8 70.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.948 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -61.8 -41.66 98.02 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.776 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.769 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.3 t80 -74.18 -45.17 50.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.123 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.4 ttp -56.57 -42.86 79.32 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.653 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.2 mmt -73.55 -40.07 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.163 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.51 -45.8 84.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.891 0.377 . . . . 0.0 110.626 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 52.4 p -70.09 -47.05 63.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.893 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.53 66.57 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.09 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.817 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.01 0.433 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.471 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 63.1 m -71.64 147.23 47.72 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.255 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.63 131.39 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.424 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.5 mt -115.58 141.58 47.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.291 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -61.98 129.58 41.58 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.983 0.42 . . . . 0.0 110.491 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.78 -13.14 57.88 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.051 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.49 140.89 33.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.04 0.448 . . . . 0.0 111.324 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.12 126.25 31.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.6 pt -112.06 158.26 12.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.527 0.679 . . . . 0.0 112.77 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 153' ' ' THR . 20.6 tp -114.26 109.97 19.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.966 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -97.0 116.48 29.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.688 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.581 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.9 ttp85 -102.85 117.11 33.91 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.795 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.1 t-80 -59.72 108.58 0.76 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.0 t -53.02 -45.31 67.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 53.7 t80 -65.16 -57.56 8.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.21 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.445 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.8 p -79.82 -15.39 57.51 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.63 -0.49 56.03 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.432 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.6 mtt -83.23 -165.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.466 0.175 . . . . 0.0 110.566 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 70.4 m-85 -134.09 138.11 45.06 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.472 HD13 HD21 ' A' ' 37' ' ' LEU . 23.0 tp -54.97 125.62 21.11 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -134.37 146.92 50.36 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 49.7 t -93.6 97.18 10.32 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -73.66 153.26 40.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.467 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.0 t -83.6 2.88 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.814 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 50.2 p -89.79 122.49 32.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.771 0.319 . . . . 0.0 110.909 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 57.5 m . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.747 179.815 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.7 m-85 -104.45 177.06 4.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.425 -1.261 . . . . 0.0 108.692 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -94.18 141.62 28.34 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 65.4 t -112.43 116.98 54.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.32 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.39 -147.9 5.8 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.758 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.445 HD13 ' OG ' ' A' ' 126' ' ' SER . 68.1 mt -116.74 151.89 35.46 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.87 0.366 . . . . 0.0 110.58 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -141.23 136.08 31.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.805 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -69.45 -46.84 65.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.15 147.75 25.48 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.754 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' THR . . . . . 0.43 HG21 HD21 ' A' ' 120' ' ' LEU . 82.4 p -107.03 -7.6 16.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.62 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.6 p -53.87 116.78 2.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.502 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.21 -161.52 19.69 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.686 -0.769 . . . . 0.0 111.495 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.464 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.3 mt-10 -118.34 -15.19 9.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.741 0.305 . . . . 0.0 111.271 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.3 -32.17 68.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.126 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.3 m -88.15 4.5 45.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.478 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -109.8 135.35 50.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.044 0.449 . . . . 0.0 111.207 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.0 m95 -128.74 116.57 19.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.604 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.8 p -78.59 124.6 28.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.475 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.16 136.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.828 0.347 . . . . 0.0 110.936 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.45 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 77.9 m-70 -128.06 150.03 72.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.618 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.8 Cg_endo -66.26 138.22 50.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.497 2.131 . . . . 0.0 112.483 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.18 -43.39 52.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.581 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 50.4 m -105.1 -170.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.286 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -92.44 -12.53 31.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -67.38 -35.48 79.41 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.318 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.2 mmt-85 -87.47 146.04 26.01 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.3 t -128.68 168.22 16.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.899 0.38 . . . . 0.0 111.411 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.71 132.28 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.151 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.56 -14.63 64.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.947 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -70.75 155.7 40.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.011 0.434 . . . . 0.0 111.258 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -71.53 144.13 49.71 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.48 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.481 HG13 HD21 ' A' ' 181' ' ' LEU . 80.0 t -94.84 111.14 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.409 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.89 154.54 35.95 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.399 0.618 . . . . 0.0 111.572 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.48 123.0 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.326 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -18.21 30.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -63.95 130.3 43.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.721 0.296 . . . . 0.0 110.739 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.619 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -72.34 115.31 11.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.481 HD21 HG13 ' A' ' 175' ' ' VAL . 66.8 mt -99.5 147.37 25.37 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.745 0.783 . . . . 0.0 112.911 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.45 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 58.4 mt -112.81 112.29 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.6 mp -92.49 136.67 33.01 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.943 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.466 HG22 ' CD1' ' A' ' 191' ' ' TYR . 83.4 t -130.46 125.51 59.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.793 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.9 m -61.2 129.0 39.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.464 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.3 t -72.54 -32.48 41.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.548 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 42.4 t -79.93 -37.28 34.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.526 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 50.5 m -114.07 0.5 14.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.18 27.59 3.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 179.466 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -108.14 142.41 38.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.03 0.443 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.2 m-85 -72.95 153.14 41.09 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.0 tp -75.76 74.86 2.73 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -74.2 150.17 40.5 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -174.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 194' ' ' LEU . . . . . 0.529 HD22 ' SG ' ' A' ' 24' ' ' CYS . 12.5 tp -99.82 116.22 31.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.522 176.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.412 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 45.3 t -110.05 147.8 32.9 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -177.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -107.64 89.76 3.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.559 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.75 -174.94 45.43 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.361 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 22.6 m-80 1.75 -79.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.435 0.694 . . . . 0.0 112.401 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 38.8 t -146.95 11.56 1.07 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.0 t -125.45 -179.17 4.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.752 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.24 136.08 47.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.27 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.559 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 17.3 m80 -127.9 173.29 10.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.007 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.8 p -127.75 131.63 69.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.103 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.2 173.45 12.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.809 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.04 91.36 4.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.165 178.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -109.89 -179.82 3.91 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -88.18 7.7 30.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.214 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -116.51 137.33 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.608 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -64.73 175.44 1.46 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.399 1.095 . . . . 0.0 113.287 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -169.71 120.78 0.68 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.895 -1.957 . . . . 0.0 107.842 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.619 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 42.0 mt -74.47 132.8 42.21 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.937 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.414 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.9 m95 -121.31 118.24 29.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.489 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 213' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 23' ' ' GLN . 33.7 p -85.4 101.44 12.6 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.059 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.767 HG22 ' HG ' ' A' ' 22' ' ' LEU . 84.6 t -92.78 104.81 16.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.86 139.42 23.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.249 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 217' ' ' ILE . 33.1 Cg_exo -62.16 105.81 0.42 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.09 1.86 . . . . 0.0 111.266 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.574 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.156 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 120.791 0.329 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.3 mt -76.64 128.32 34.48 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 9.7 mmt85 -116.53 157.78 24.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.328 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.421 ' HG1' ' N ' ' A' ' 111' ' ' ARG . 10.7 p -68.29 155.51 39.59 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.748 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.93 -8.26 1.31 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.441 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.0 m-20 -69.15 143.02 54.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 15.3 tt0 -89.57 116.29 27.61 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.537 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -132.54 175.65 10.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.687 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -135.15 142.03 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.575 176.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.772 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -103.53 117.91 35.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 42.5 mt-30 -118.97 149.94 40.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.674 0.75 . . . . 0.0 112.458 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.1 p -137.26 142.59 41.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.558 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.9 m -84.85 121.97 28.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.475 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.63 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -112.77 120.07 40.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.095 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 m -125.46 134.16 52.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.539 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -170.77 145.43 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.486 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.5 m80 58.26 39.12 25.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.793 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 61.45 25.61 15.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.258 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -127.33 133.47 50.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.282 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -122.64 148.71 44.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.474 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -161.85 173.1 15.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.553 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -120.53 136.54 54.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.569 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -125.78 141.03 52.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.533 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.645 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 51.4 t -104.75 146.23 29.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.491 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.502 HD21 HD13 ' A' ' 130' ' ' LEU . 31.9 tp -65.34 112.6 3.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.943 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.51 163.8 13.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.571 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.4 164.92 10.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.703 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.07 143.53 42.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.69 179.2 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.22 18.73 21.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.277 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -124.72 147.55 48.56 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.42 -138.75 20.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.485 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -80.51 7.56 9.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.734 0.302 . . . . 0.0 110.787 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.447 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.77 32.44 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.095 179.619 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -78.08 137.61 38.32 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 110.449 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -78.85 150.81 32.15 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.583 0.706 . . . . 0.0 111.449 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 p90 -145.21 -166.28 2.38 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.488 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.8 mt -129.09 142.51 50.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.403 0.62 . . . . 0.0 112.096 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 tt0 . . . . . 0 CA--C 1.503 -0.854 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.797 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 HG11 ' A' ' 21' ' ' VAL . 46.1 tp . . . . . 0 C--O 1.23 0.065 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.1 m -46.69 -54.0 10.53 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.464 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.9 pt -69.01 -18.71 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.687 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.87 -2.21 47.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.068 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.411 HG23 ' HG2' ' A' ' 19' ' ' GLU . 30.4 m -84.7 133.01 34.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.387 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.88 162.69 33.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.556 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -126.42 133.64 68.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.786 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 18' ' ' ASP . 15.0 mt -82.69 65.4 7.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.509 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.8 mm-40 -45.01 -61.22 1.71 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -124.57 164.66 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.651 0.739 . . . . 0.0 112.796 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 57.1 m -157.47 86.73 0.94 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.03 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.17 154.84 28.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.271 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.7 t -68.55 150.49 47.97 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -51.82 -43.51 34.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.078 0.466 . . . . 0.0 110.162 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HB3' ' NH1' ' A' ' 76' ' ' ARG . 18.4 ttp-105 -56.58 -57.13 13.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.912 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.61 89.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.091 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.6 tp -61.83 -46.49 89.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.256 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--N 1.324 -0.53 0 CA-C-O 120.958 0.409 . . . . 0.0 110.488 179.778 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.823 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.0 mm-40 . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 118.666 -0.683 . . . . 0.0 112.635 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.738 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 27.3 tttm -86.32 -50.86 6.62 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 125.469 1.508 . . . . 0.0 111.641 -2.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -57.53 -35.52 70.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.041 -1.436 . . . . 0.0 113.264 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.653 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 12.8 mmmm -64.18 -33.77 76.56 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.45 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.823 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 7.7 t80 -74.17 -49.43 23.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.224 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 50.0 ttm -59.45 -44.32 92.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.219 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.4 ttt -70.15 -49.25 52.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.534 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.8 -38.4 75.45 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.047 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 -46.77 57.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.83 -54.35 48.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.572 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.087 -179.648 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.421 ' N ' ' HG1' ' A' ' 16' ' ' THR . 14.8 ptm180 . . . . . 0 N--CA 1.458 -0.068 0 CA-C-O 120.886 0.374 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 84.4 m -78.98 144.28 34.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.411 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.09 130.39 35.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.4 mt -115.15 142.36 46.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.332 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.11 130.74 46.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.044 0.45 . . . . 0.0 110.529 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.6 -13.04 59.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.069 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -83.05 140.02 32.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.022 0.439 . . . . 0.0 111.456 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.99 128.18 33.82 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.5 pt -112.65 159.72 12.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.649 0.738 . . . . 0.0 112.935 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.4 tp -115.66 107.19 14.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.686 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.406 ' CD2' HD23 ' A' ' 69' ' ' LEU . 47.1 mt -95.37 117.62 30.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.74 -178.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 68' ' ' VAL . 62.3 ttp85 -104.04 116.04 31.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.696 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.6 t-80 -57.69 110.71 0.94 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.9 t -52.76 -52.46 56.42 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 48.6 t80 -57.73 -66.9 0.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.0 p -66.72 -33.06 74.81 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.02 -3.11 80.44 Favored Glycine 0 C--N 1.322 -0.204 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.676 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.3 mtt -81.94 -165.5 1.0 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.716 -0.242 . . . . 0.0 110.434 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.496 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.7 m-85 -133.46 139.25 46.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.502 HD13 HD21 ' A' ' 37' ' ' LEU . 26.0 tp -54.66 127.14 26.77 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.8 t -136.5 143.99 44.07 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -91.82 97.83 11.23 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.511 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.5 mt -73.76 145.31 45.18 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.522 -178.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.5 p -76.71 -0.04 22.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.757 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.6 p -91.25 120.44 32.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 110.94 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 49.4 m . . . . . 0 C--N 1.324 -0.523 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.779 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.516 0.674 . . . . 0.0 112.139 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 14.5 m-85 -103.85 172.72 6.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.995 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.26 144.63 25.67 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 120.995 0.426 . . . . 0.0 109.867 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 74.8 t -114.13 117.9 56.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.288 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.84 -150.44 5.81 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.008 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.447 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 65.7 mt -114.89 151.96 33.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.925 0.393 . . . . 0.0 110.776 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -140.14 142.76 35.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.859 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.61 -51.62 11.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.529 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -83.27 146.25 28.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.0 p -106.54 -7.72 17.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 65.8 p -54.73 114.07 1.56 Allowed 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.49 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.06 -160.06 21.84 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.706 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.427 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.6 mt-10 -118.85 -14.85 9.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.745 0.307 . . . . 0.0 111.429 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.3 -34.35 66.41 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.4 m -89.51 8.01 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -111.02 133.51 53.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.104 0.478 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.3 m95 -128.13 115.98 19.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.741 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 13.5 p -78.35 126.36 30.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.208 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.38 136.18 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.421 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 86.5 m-70 -129.25 151.47 77.84 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.187 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.67 140.16 55.47 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.593 2.195 . . . . 0.0 112.397 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.73 51.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.746 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 7.7 t -110.79 -168.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.441 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -95.57 4.75 52.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.333 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -84.04 -30.65 25.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.905 0.383 . . . . 0.0 111.004 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.0 mmt-85 -92.27 144.23 25.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.7 m -124.94 164.79 19.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.935 0.397 . . . . 0.0 111.64 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 171' ' ' GLU . . . . . 0.465 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.69 130.64 43.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.317 179.427 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.7 -16.95 60.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.027 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -67.79 156.18 37.62 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.952 0.406 . . . . 0.0 111.093 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -72.23 144.67 48.37 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.507 HG13 HD21 ' A' ' 181' ' ' LEU . 95.5 t -94.68 113.23 28.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -77.0 155.0 32.91 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.649 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 216' ' ' PRO . 22.8 t -69.93 119.91 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 176.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.94 -13.76 31.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.309 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -66.38 132.48 48.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.813 0.339 . . . . 0.0 110.932 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.511 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.2 m-20 -73.49 110.46 7.8 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.747 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.507 HD21 HG13 ' A' ' 175' ' ' VAL . 56.6 mt -97.34 150.64 20.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.748 0.785 . . . . 0.0 112.985 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.501 HD13 ' NE2' ' A' ' 209' ' ' GLN . 48.0 mt -115.61 113.07 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 176.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.64 136.37 33.28 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.028 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.469 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.1 t -128.47 127.61 67.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.812 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 6.6 m -65.3 125.08 23.95 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.427 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.1 t -69.54 -30.36 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.963 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 94.1 p -79.94 -37.0 35.42 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.403 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 73.9 p -120.2 9.31 11.06 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 46.26 31.96 1.37 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.386 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 24.2 mtt180 -111.05 140.42 45.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.085 0.469 . . . . 0.0 110.983 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.5 m-85 -72.84 153.61 40.98 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.6 tp -75.57 75.93 2.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 175.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.26 151.07 38.41 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 115.68 1.734 . . . . 0.0 115.68 -174.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.2 tp -100.42 117.45 34.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.585 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 34.1 t -112.03 146.03 38.63 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -105.32 92.67 4.3 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.609 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.2 -173.85 44.76 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.375 -0.916 . . . . 0.0 111.419 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.531 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.1 m120 -3.28 -76.3 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.362 0.665 . . . . 0.0 112.51 -179.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 78.2 p -147.7 13.72 1.05 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.116 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.1 t -128.42 179.45 5.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.63 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.9 m95 -106.07 136.45 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.219 0.533 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.609 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 14.8 m80 -128.19 173.11 10.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.029 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.7 p -127.57 131.06 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.146 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -147.52 173.11 12.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.683 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.22 93.91 5.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.152 178.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.98 176.86 4.84 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.304 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -85.69 10.11 14.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.072 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -118.09 134.59 54.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.501 ' NE2' HD13 ' A' ' 182' ' ' ILE . 95.4 mt-30 -63.62 174.7 1.27 Allowed 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 122.389 1.09 . . . . 0.0 113.133 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.4 m -167.52 120.82 0.94 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.939 -1.937 . . . . 0.0 107.734 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.511 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.6 mt -74.53 128.76 36.34 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.004 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -115.78 147.31 41.1 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.498 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.3 t -113.62 98.57 7.14 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.326 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.1 t -91.63 100.45 11.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -117.6 135.79 23.39 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.481 ' HA ' HG12 ' A' ' 20' ' ' VAL . 17.5 Cg_endo -60.07 107.14 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 121.835 1.69 . . . . 0.0 111.135 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.537 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.6 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.121 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 . . . . . 0 CA--C 1.515 -0.385 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 25.4 mt -80.53 121.94 26.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -110.96 157.89 19.39 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.09 0.472 . . . . 0.0 111.287 -179.104 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 p -67.62 156.2 37.38 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.661 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 71.58 -4.25 1.93 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.818 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 2.9 m-20 -73.15 133.01 43.94 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.691 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.84 121.36 25.86 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.7 m -136.93 173.93 12.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.103 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -135.62 136.76 50.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.251 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -97.49 122.92 41.1 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.672 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 38.6 mt-30 -122.84 149.29 44.37 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 112.029 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -136.18 144.07 44.76 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.627 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.4 m -86.72 122.06 30.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.04 120.51 41.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.065 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.8 m -124.15 132.29 53.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.039 0.447 . . . . 0.0 111.761 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.1 tt -169.3 146.0 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.507 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 m80 59.79 39.66 20.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.7 mppt? 61.3 21.52 12.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.372 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -124.94 144.66 50.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -131.5 146.33 52.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.978 0.418 . . . . 0.0 111.384 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -157.38 170.25 22.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.604 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -118.42 137.25 53.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.569 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -125.71 143.68 50.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.601 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.4 p -107.94 139.72 42.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 0.0 110.435 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.4 tp -60.23 109.81 1.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.008 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.498 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.06 164.34 12.51 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.6 -179.219 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.16 162.03 10.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.766 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.95 142.83 44.63 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.557 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.22 23.17 8.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.366 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -130.57 147.12 52.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.872 0.367 . . . . 0.0 110.561 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.57 -125.34 6.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.519 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.422 ' HA ' HD22 ' A' ' 44' ' ' ASN . 1.5 t-20 -93.56 8.02 42.35 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.749 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.16 31.88 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.296 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 46' ' ' LEU . 17.5 mt -80.41 134.39 36.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.602 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.53 149.72 38.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.65 0.738 . . . . 0.0 111.163 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -146.07 -166.09 2.37 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.265 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 37' ' ' LEU . 24.7 mt -128.94 145.19 51.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.386 0.613 . . . . 0.0 111.736 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 tt0 . . . . . 0 CA--C 1.5 -0.951 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.767 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.642 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp . . . . . 0 C--O 1.232 0.14 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.4 m -49.73 -51.76 36.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.498 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.8 pt -67.38 -18.4 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -178.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 58.4 m -100.63 14.15 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.652 0.263 . . . . 0.0 111.334 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -91.86 129.82 37.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -136.93 158.7 43.85 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.138 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 t -122.8 132.7 70.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.694 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.73 67.59 6.66 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 178.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 12.1 mm-40 -46.81 -63.99 0.88 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.426 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 57.3 mm-40 -123.01 162.08 23.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.712 0.768 . . . . 0.0 112.922 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.5 p -153.59 86.2 1.2 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.919 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -115.8 157.03 25.0 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.661 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.2 t -70.02 150.74 46.32 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.8 t -52.84 -42.87 44.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.899 0.38 . . . . 0.0 110.323 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.1 ttp-105 -58.92 -56.87 16.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.87 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.53 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.81 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.4 -44.63 94.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.119 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 0.0 110.52 179.908 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.78 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.454 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.78 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 9.4 mtmp? -88.63 -51.82 5.48 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 125.008 1.323 . . . . 0.0 111.038 -3.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -64.85 -28.57 69.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.676 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 41.4 ttmt -61.15 -41.66 97.15 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.634 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.615 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 53.3 t80 -73.84 -45.67 49.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.958 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.3 ttt -56.63 -39.03 72.94 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.759 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 mmt -74.06 -45.65 48.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.138 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.44 -40.99 79.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.755 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.2 p -72.93 -45.65 56.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.299 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.42 -46.46 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.274 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.665 179.764 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 . . . . . 0 N--CA 1.457 -0.084 0 CA-C-O 121.069 0.462 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 112' ' ' THR . . . . . 0.507 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 86.5 m -79.11 146.49 33.18 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.0 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.41 131.63 35.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.576 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.96 142.91 46.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.297 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.89 129.8 42.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.119 0.485 . . . . 0.0 110.443 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -13.3 58.1 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.197 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.65 139.91 33.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.456 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.6 127.25 32.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.26 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -111.87 159.71 11.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.606 0.717 . . . . 0.0 112.789 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.426 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -115.39 109.18 17.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.935 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.416 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.12 118.41 33.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.675 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.485 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 15.8 ttp-105 -104.24 116.59 32.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.67 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.2 t-80 -59.78 106.75 0.52 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -51.49 -44.71 62.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -177.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 26.2 t80 -65.6 -59.17 4.23 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 149' ' ' LEU . 59.8 p -78.2 -14.49 59.43 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 73.42 0.87 55.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.383 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -84.58 -164.79 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.441 0.162 . . . . 0.0 110.64 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.423 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.1 m-85 -134.85 138.8 44.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.439 HD13 HD21 ' A' ' 37' ' ' LEU . 24.5 tp -55.97 124.8 18.92 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.593 ' SG ' HD21 ' A' ' 133' ' ' LEU . 19.3 p -134.5 147.72 50.4 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.4 t -93.76 98.52 11.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.643 -1.162 . . . . 0.0 107.891 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.593 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.1 mt -75.7 149.67 38.04 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.283 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.7 t -80.63 4.56 18.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.861 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 79.8 p -93.5 118.87 31.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.755 0.312 . . . . 0.0 111.263 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 48.4 t . . . . . 0 C--N 1.324 -0.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.251 179.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 121.518 0.675 . . . . 0.0 112.44 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.534 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 11.0 m-85 -103.32 171.62 7.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.907 177.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -91.01 144.05 26.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.72 118.53 58.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.242 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.21 -150.48 5.9 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.148 -1.025 . . . . 0.0 113.172 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 81.0 mt -116.55 143.63 45.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.051 0.453 . . . . 0.0 110.832 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 1.8 tp60 -131.74 140.82 49.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.583 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.6 -51.49 19.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.509 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.468 ' HB3' HG22 ' A' ' 154' ' ' THR . 10.0 m-20 -84.61 152.17 24.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.541 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.7 p -107.86 -3.93 18.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.731 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' THR . . . . . 0.468 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.45 117.68 3.27 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.602 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 121.93 -161.29 16.11 Favored Glycine 0 N--CA 1.441 -0.992 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.829 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.528 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -118.89 -12.21 9.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.707 0.289 . . . . 0.0 111.23 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.34 -31.87 67.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.5 m -89.6 6.85 39.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.655 0.264 . . . . 0.0 111.503 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.9 131.8 54.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.08 0.467 . . . . 0.0 111.305 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.462 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.5 m95 -127.14 115.27 18.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.711 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.5 p -78.13 126.24 30.52 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.152 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.462 HD12 HG21 ' A' ' 175' ' ' VAL . 2.4 pt -87.57 135.19 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 0.0 110.794 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.407 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 83.2 m-70 -127.86 149.35 70.43 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.202 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.651 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.4 Cg_endo -65.4 136.69 47.97 Favored 'Trans proline' 0 CA--C 1.517 -0.341 0 C-N-CA 122.502 2.135 . . . . 0.0 112.323 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.423 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.08 -39.55 49.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.396 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 79.0 p -104.85 -173.12 2.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.516 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -94.11 -7.09 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.931 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.445 ' HB2' ' NH1' ' A' ' 169' ' ' ARG . 2.3 mm100 -73.78 -34.03 64.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.092 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.651 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 69.7 mmt-85 -87.97 145.13 26.16 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.829 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.1 t -127.13 167.97 15.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.459 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.23 133.58 50.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.254 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.35 -16.99 58.55 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.132 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -68.04 156.33 37.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.916 0.389 . . . . 0.0 111.103 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.27 145.47 47.87 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.462 HG21 HD12 ' A' ' 162' ' ' ILE . 91.1 t -95.11 112.38 27.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.94 0.4 . . . . 0.0 110.263 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -77.62 154.56 32.13 Favored 'General case' 0 CA--C 1.5 -0.954 0 CA-C-O 121.353 0.597 . . . . 0.0 111.595 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 45.7 t -70.53 122.14 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.89 -13.3 32.01 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.963 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -70.16 130.13 41.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.73 0.3 . . . . 0.0 110.741 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.486 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 10.4 m-20 -73.51 115.24 12.67 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.462 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -99.84 149.79 23.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.818 0.818 . . . . 0.0 113.122 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.512 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.5 mt -114.26 113.17 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.84 136.87 32.86 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.175 0.512 . . . . 0.0 112.227 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.471 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.3 t -128.77 125.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.764 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 34.5 t -65.19 123.92 20.81 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.4 t -67.44 -33.53 62.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.74 -39.54 35.92 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 65.3 m -113.35 6.94 17.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.25 32.19 0.93 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 27.6 mtt180 -114.32 141.31 47.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.918 0.39 . . . . 0.0 110.73 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.0 m-85 -72.24 153.54 41.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.25 76.8 2.37 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.407 -2.072 . . . . 0.0 105.407 175.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -76.57 151.31 36.35 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -174.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.8 tp -100.64 117.3 34.48 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.672 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.429 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 42.7 t -111.23 146.33 37.14 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.86 90.31 3.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.617 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.12 -174.53 40.77 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.464 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 71.4 m-20 -2.12 -76.62 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.42 0.688 . . . . 0.0 112.594 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 39.7 t -147.62 12.68 1.03 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.05 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.8 p -127.25 -179.86 5.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.1 m95 -107.22 135.92 47.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.207 0.527 . . . . 0.0 111.198 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.617 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 15.5 m80 -127.74 173.1 10.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.108 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.86 131.98 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.104 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -149.33 172.44 14.89 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.66 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.14 94.54 6.56 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.259 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.21 174.83 5.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.129 -177.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -83.76 9.37 12.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.038 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 76.4 mm-40 -115.35 136.85 52.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.534 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.512 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.8 mt-30 -66.29 175.31 2.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 122.295 1.045 . . . . 0.0 113.047 -178.543 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.9 m -167.98 120.82 0.88 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 113.025 -1.898 . . . . 0.0 107.891 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 37.1 mt -74.74 127.59 33.52 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.976 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.413 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -114.71 146.75 40.56 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.617 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.2 m -113.76 100.04 8.16 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.222 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 22' ' ' LEU . 75.0 t -91.31 99.95 10.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.818 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.0 139.38 22.89 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.122 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.477 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.8 Cg_exo -63.6 106.94 0.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.018 1.812 . . . . 0.0 111.197 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.3 mm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.976 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.477 ' CD1' ' HD2' ' A' ' 176' ' ' ARG . 40.5 m-85 . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 120.907 0.384 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.8 mt -81.36 123.64 28.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -111.04 156.57 21.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.939 0.399 . . . . 0.0 111.069 -179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.8 p -67.19 155.65 38.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.844 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.43 -8.3 1.38 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.77 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -69.05 132.27 46.35 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.913 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -79.29 123.03 27.07 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.484 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.0 m -138.23 169.78 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.678 ' HB ' ' SG ' ' A' ' 36' ' ' CYS . 2.5 m -132.74 136.19 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.335 176.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.716 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.19 126.09 42.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.808 0.337 . . . . 0.0 110.918 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 44.1 mt-30 -125.14 151.06 46.26 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.488 0.661 . . . . 0.0 111.787 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -137.63 144.12 41.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.541 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.7 m -86.12 122.03 29.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.327 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.615 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.07 121.99 44.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.144 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.2 m -125.63 137.66 53.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.991 0.424 . . . . 0.0 111.616 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.0 tt -174.16 143.32 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.582 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 43.5 m80 59.64 39.34 21.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.005 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.429 ' HE2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.4 22.6 13.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.378 179.589 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -126.67 129.09 47.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.612 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -119.61 145.85 46.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.26 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -156.74 174.3 15.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.683 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -121.41 135.88 55.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.478 178.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.484 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -123.69 143.88 49.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.72 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.678 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 4.3 t -107.11 135.05 49.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.977 0.418 . . . . 0.0 110.56 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.9 tp -59.89 103.3 0.2 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.882 179.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -101.56 164.61 11.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.634 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.59 158.63 11.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.545 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -131.09 150.09 52.31 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.75 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.07 -4.25 89.99 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.918 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -109.04 161.55 15.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.891 0.377 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.69 -141.63 24.76 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.294 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -84.38 11.86 7.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.776 0.322 . . . . 0.0 110.641 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.14 30.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.6 mt -79.59 135.83 36.69 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.7 m -76.75 150.84 36.19 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.304 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -144.89 -170.29 3.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.706 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.6 mt -127.4 143.04 51.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.313 0.578 . . . . 0.0 112.141 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' CD ' HD11 ' A' ' 64' ' ' ILE . 0.9 OUTLIER . . . . . 0 CA--C 1.502 -0.882 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.662 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HG11 ' A' ' 21' ' ' VAL . 43.3 tp . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.6 m -54.72 -40.01 68.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 38' ' ' ALA . 21.0 pt -71.66 -16.86 19.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -178.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 37' ' ' LEU . 16.6 t -105.59 4.8 30.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.247 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.1 m -76.24 125.92 30.05 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.2 161.18 35.63 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.8 t -125.11 133.19 70.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.673 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.1 mt -80.7 66.19 6.13 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.7 mm-40 -45.75 -61.39 1.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 55.5 mm-40 -124.37 164.36 19.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.662 0.744 . . . . 0.0 112.816 -177.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.0 t -156.43 84.51 0.98 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.829 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.1 153.23 29.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.489 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.9 p -67.27 148.61 51.49 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.9 t -50.33 -42.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.976 0.417 . . . . 0.0 110.264 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.4 ttp85 -59.67 -50.47 73.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.14 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.03 99.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.755 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.33 -46.05 88.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.182 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 120.971 0.415 . . . . 0.0 110.583 179.892 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.826 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 7.7 mm-40 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.826 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 51.6 mtmt -86.33 -51.59 6.15 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 120.353 1.433 . . . . 0.0 111.898 -2.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -60.51 -37.35 80.84 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.977 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.622 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 52.5 mttp -57.9 -38.03 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.276 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.821 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.1 t80 -74.04 -44.38 54.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.916 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.6 ttt -57.15 -37.95 72.82 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.431 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.3 mmt -72.36 -43.7 63.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.372 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -62.06 -34.53 76.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.585 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.4 m -72.92 -49.05 31.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.279 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.98 44.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.391 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.291 -179.701 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.276 0.56 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 92.2 m -75.47 146.0 40.99 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.139 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.33 134.33 36.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.1 mt -117.64 142.06 47.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.864 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -61.67 127.96 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.67 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.45 -9.43 55.83 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.968 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -85.39 139.42 31.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 111.079 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.26 127.14 32.38 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.8 pt -112.12 157.7 12.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.587 0.708 . . . . 0.0 112.854 -178.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.411 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -113.26 109.08 18.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.936 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.1 mt -97.06 117.71 31.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.554 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.2 ttp85 -104.22 117.79 35.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.689 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.4 t-80 -60.02 105.45 0.4 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 177.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 45.7 t -46.5 -53.91 10.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.415 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.1 t80 -58.12 -71.48 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.402 ' OG ' HD13 ' A' ' 149' ' ' LEU . 77.9 p -62.21 -25.05 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLY . . . . . 0.513 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 81.87 -0.82 87.93 Favored Glycine 0 C--N 1.322 -0.234 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.288 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 45.9 mtt -83.03 -164.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.489 0.185 . . . . 0.0 110.673 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.456 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.0 m-85 -135.61 139.28 43.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.56 126.1 23.86 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.7 t -136.06 147.97 48.12 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.8 t -94.42 99.07 11.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.8 mt -77.37 146.0 36.93 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.624 -178.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -0.12 17.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.932 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.2 p -88.87 121.6 31.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.72 0.295 . . . . 0.0 110.974 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 42.0 t . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.712 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.444 -0.747 0 CA-C-O 121.221 0.534 . . . . 0.0 111.573 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 10.5 m-85 -99.49 170.49 8.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.141 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -90.15 143.14 27.04 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.86 116.76 53.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.275 178.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.05 -151.85 6.56 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.881 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 68.7 mt -113.89 147.0 39.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.81 0.338 . . . . 0.0 110.561 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -136.69 140.79 42.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.099 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -74.16 -47.94 32.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.594 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -84.99 146.89 26.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.1 p -107.98 -10.26 15.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.99 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.1 p -54.52 112.37 0.99 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.355 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 131.87 -158.44 22.86 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.341 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.473 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.2 mt-10 -121.8 -14.43 8.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.717 0.294 . . . . 0.0 111.24 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ALA . . . . . 0.423 ' N ' ' HB2' ' A' ' 187' ' ' SER . . . -57.61 -32.79 67.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.174 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.3 m -89.45 5.97 42.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.604 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -110.19 132.56 54.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.111 0.481 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.452 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.47 117.18 21.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.649 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 7.7 p -79.13 128.01 32.75 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.133 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.553 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.26 134.33 28.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' HIS . . . . . 0.478 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 82.1 m-70 -127.96 151.85 76.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.291 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.666 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.6 Cg_endo -68.78 137.45 38.47 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.504 2.136 . . . . 0.0 112.291 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.415 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.45 -40.41 43.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.438 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.1 p -105.52 -171.12 1.85 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.499 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -95.51 -0.94 51.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.0 -36.06 49.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.989 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.666 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.2 mmp_? -87.57 149.45 24.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.525 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 47.7 t -131.75 161.74 32.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.017 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.27 126.75 29.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.137 179.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.61 -14.91 57.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.688 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.79 156.57 38.77 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -72.93 136.85 45.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.372 178.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.553 HG21 HD12 ' A' ' 162' ' ' ILE . 84.3 t -85.57 119.29 33.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.378 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ARG . . . . . 0.477 ' HD2' ' CD1' ' A' ' 13' ' ' PHE . 11.0 mmm180 -84.6 153.99 22.86 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-O 121.364 0.602 . . . . 0.0 111.513 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.423 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.9 t -69.66 122.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.28 -8.3 38.05 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.295 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -73.09 131.44 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.742 0.306 . . . . 0.0 110.9 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.514 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 24.5 m-20 -72.57 110.97 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 69.0 mt -97.51 149.68 21.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.505 HD13 ' NE2' ' A' ' 209' ' ' GLN . 54.4 mt -114.41 113.17 42.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.13 138.6 31.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.101 0.477 . . . . 0.0 112.069 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.451 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.5 t -130.21 123.66 56.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.81 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 189' ' ' GLU . 87.5 p -65.23 119.15 10.37 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.1 t -63.17 -31.86 54.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.19 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 187' ' ' SER . . . . . 0.423 ' HB2' ' N ' ' A' ' 157' ' ' ALA . 44.2 t -77.49 -39.2 47.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -178.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 m -116.66 9.89 14.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 185' ' ' SER . 0.4 OUTLIER 44.38 32.93 0.78 Allowed 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.584 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 29.0 mtt180 -113.31 140.27 48.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.95 0.405 . . . . 0.0 110.815 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -72.17 153.62 41.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.318 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 31.1 tp -74.82 76.54 2.11 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 175.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -75.98 150.03 37.51 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.3 tp -100.14 116.53 32.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.602 177.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 49.2 p -110.1 145.39 37.22 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -105.82 91.05 3.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.15 178.83 53.43 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.032 179.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.517 ' C ' ' O ' ' A' ' 197' ' ' GLY . 54.5 m-20 9.55 -82.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.326 0.651 . . . . 0.0 112.51 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 47.5 t -143.08 4.11 1.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.527 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.4 p -119.89 -179.35 3.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.195 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.615 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -105.83 139.12 40.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.249 0.547 . . . . 0.0 111.341 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.481 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 19.0 m80 -130.41 172.5 11.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.073 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.26 133.89 67.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.223 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -151.96 170.96 18.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.662 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.48 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -97.61 96.53 8.35 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.97 174.8 5.84 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.113 -177.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -83.57 11.11 7.6 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.051 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 68.8 mt-30 -117.63 135.76 53.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.441 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.505 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.0 mt-30 -65.56 175.23 1.89 Allowed 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 122.31 1.052 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.4 m -168.62 120.82 0.8 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.084 -1.871 . . . . 0.0 107.836 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 27.9 mt -74.88 129.11 37.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.077 0.465 . . . . 0.0 109.85 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.0 m95 -116.06 146.74 41.95 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.632 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 45.7 t -113.7 101.77 9.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.133 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.716 HG22 ' HG ' ' A' ' 22' ' ' LEU . 79.3 t -92.88 101.78 12.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.779 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.84 140.3 23.87 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.2 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.423 ' HD3' HG13 ' A' ' 177' ' ' VAL . 24.0 Cg_exo -63.74 104.03 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 121.975 1.783 . . . . 0.0 110.984 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 62' ' ' LEU . 3.8 mm . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.383 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 120.844 0.354 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.0 mt -82.51 121.67 27.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.442 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.26 157.16 19.1 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.012 0.434 . . . . 0.0 111.086 -179.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.402 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.6 p -68.27 156.63 37.28 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.45 -8.94 1.11 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.701 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.442 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.8 m-20 -67.91 135.35 52.33 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -82.0 118.05 22.69 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.504 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.2 m -134.83 172.62 15.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.666 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -134.91 139.31 47.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.2 176.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.796 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.5 mp -100.0 120.93 40.59 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.689 0.281 . . . . 0.0 110.662 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.441 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 78.2 mt-30 -118.19 160.19 22.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.438 0.637 . . . . 0.0 111.793 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -146.76 143.61 28.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.319 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -88.04 121.59 30.63 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.054 0.454 . . . . 0.0 110.405 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.617 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.0 121.72 45.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.978 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 m -126.22 130.09 50.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.986 0.422 . . . . 0.0 111.86 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.8 tt -168.74 149.23 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.51 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 44.0 m80 59.28 39.32 22.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.11 23.67 13.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -127.77 147.17 50.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.455 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -131.75 148.78 52.6 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.967 0.413 . . . . 0.0 111.028 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -161.67 165.28 28.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.672 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -113.32 135.22 54.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.428 178.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.3 mt -124.69 142.33 51.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.728 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.601 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 47.6 t -106.36 145.58 31.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.4 . . . . 0.0 110.588 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 130' ' ' LEU . 33.4 tp -65.32 114.59 4.87 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.585 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.492 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -113.8 164.61 13.52 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.417 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.434 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -169.02 161.1 10.4 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.594 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.67 144.17 51.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.724 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.8 -9.23 86.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.775 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -106.01 162.87 13.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 111.146 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.97 -142.5 26.52 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.477 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 19.6 p30 -83.02 9.71 9.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.747 0.308 . . . . 0.0 110.833 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.29 0.38 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.177 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.2 mt -79.44 137.59 37.3 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.938 0.399 . . . . 0.0 110.487 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.4 m -77.91 153.89 32.17 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.634 0.73 . . . . 0.0 111.524 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -148.34 -166.11 2.45 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.319 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 37' ' ' LEU . 25.5 mt -130.44 143.89 51.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.299 0.571 . . . . 0.0 112.429 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 mt-10 . . . . . 0 CA--C 1.503 -0.859 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.594 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.575 HD11 HG11 ' A' ' 21' ' ' VAL . 45.2 tp . . . . . 0 C--O 1.231 0.094 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.2 p -45.26 -56.63 4.66 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.492 HD12 ' HB1' ' A' ' 38' ' ' ALA . 30.4 pt -67.98 -18.24 23.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.666 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.59 -3.29 46.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.917 0.389 . . . . 0.0 111.679 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.459 HG22 ' OG ' ' A' ' 124' ' ' SER . 23.0 m -83.66 134.74 34.77 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -138.82 163.62 31.77 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 t -127.61 133.83 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.408 HD11 HG11 ' A' ' 20' ' ' VAL . 20.5 mt -82.45 65.33 7.53 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.8 mm-40 -45.22 -66.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.498 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 8.1 mm100 -119.25 166.61 12.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.743 0.783 . . . . 0.0 113.1 -177.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.4 t -159.62 82.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.402 -1.272 . . . . 0.0 108.746 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.9 mt -111.6 157.11 20.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.388 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 t -69.13 150.04 47.99 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 41.3 t -52.88 -42.94 44.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.06 0.457 . . . . 0.0 110.18 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -59.24 -51.74 68.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.25 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.15 98.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.721 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.81 -44.32 96.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.001 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 . . . . . 0 C--N 1.323 -0.552 0 CA-C-O 120.911 0.386 . . . . 0.0 110.645 179.864 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.759 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 15.3 mm-40 . . . . . 0 CA--C 1.534 0.35 0 CA-C-O 118.644 -0.694 . . . . 0.0 112.74 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.725 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 46.9 mtmt -86.27 -49.81 7.42 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 0.0 110.881 -2.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.432 ' O ' ' HG2' ' A' ' 102' ' ' MET . 49.0 t90 -53.97 -43.66 70.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.651 -178.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.612 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -58.37 -30.3 66.68 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.153 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.759 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 9.8 t80 -73.87 -47.52 37.59 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.523 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 14.9 tpt -56.71 -38.62 72.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.603 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 98' ' ' TRP . 91.2 mmm -72.74 -43.37 63.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -57.45 -40.01 77.53 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.474 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 74.1 p -72.45 -46.83 53.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.97 -26.61 67.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.894 179.862 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.402 ' N ' ' HG1' ' A' ' 16' ' ' THR . 14.4 ptm180 . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.913 0.387 . . . . 0.0 111.124 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.7 m -75.8 146.7 39.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.287 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.2 131.68 35.31 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.768 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -116.04 141.98 47.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.244 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.58 129.13 39.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.451 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.16 -13.43 57.24 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.951 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.37 141.93 32.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.053 0.454 . . . . 0.0 111.303 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.74 125.22 31.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.3 pt -110.31 160.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.528 HD21 HG21 ' A' ' 153' ' ' THR . 20.0 tp -116.84 111.62 19.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.036 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.402 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.7 mt -98.82 117.69 33.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 17.2 ttp-105 -103.24 115.53 30.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.763 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.9 t-80 -58.18 108.19 0.57 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.459 ' OG ' HG22 ' A' ' 66' ' ' THR . 44.0 m -52.82 -46.27 67.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 60.4 t80 -63.33 -59.28 4.92 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 t -78.27 -17.0 57.24 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.67 -2.33 59.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.552 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 62.3 mtm -84.13 -167.11 1.63 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.463 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 63.5 m-85 -130.93 139.0 50.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 37' ' ' LEU . 30.3 tp -54.87 128.69 34.32 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 46.2 t -137.72 147.78 45.07 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.5 t -95.07 98.38 10.62 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.8 mt -75.33 153.43 37.86 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.618 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.0 t -80.66 -4.59 54.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.769 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 32.4 p -83.95 122.01 28.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.728 0.299 . . . . 0.0 111.131 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 50.8 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 121.312 0.577 . . . . 0.0 111.641 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.496 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 15.6 m-85 -101.61 172.22 7.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.143 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -90.52 145.13 25.13 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 92.7 t -115.2 117.39 55.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.307 178.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.39 -149.58 5.84 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.87 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.0 mt -114.63 150.03 35.73 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.852 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -137.4 139.34 40.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.775 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -68.63 -68.43 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.543 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -74.97 154.35 38.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.712 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' THR . . . . . 0.528 HG21 HD21 ' A' ' 120' ' ' LEU . 81.4 p -106.3 3.96 28.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.013 0.435 . . . . 0.0 111.096 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 74.9 p -59.15 114.12 2.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.312 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.35 -164.39 18.94 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.656 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.8 mt-10 -116.27 -13.8 11.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.676 0.274 . . . . 0.0 111.306 -179.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.34 65.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.198 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 30.0 p -88.83 6.67 37.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.632 0.253 . . . . 0.0 111.674 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -110.4 133.53 53.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.153 0.501 . . . . 0.0 111.347 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.3 m95 -127.78 115.96 19.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.623 -179.059 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.4 p -78.12 123.33 26.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.049 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.435 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -85.89 136.93 21.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.99 0.424 . . . . 0.0 110.982 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -128.75 149.84 73.24 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.034 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.665 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 38.5 Cg_endo -66.71 137.79 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.449 2.1 . . . . 0.0 112.38 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 180' ' ' ASP . . . -75.61 -42.47 51.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -107.92 -169.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -91.64 -8.59 46.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.066 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -67.98 -38.31 82.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.047 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.665 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.6 mmp_? -88.59 150.84 22.85 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.824 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 60.4 m -133.28 167.83 19.67 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.881 0.372 . . . . 0.0 111.011 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.53 127.94 34.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.528 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.27 -14.72 63.28 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.086 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.53 155.98 40.01 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.031 0.443 . . . . 0.0 111.313 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 43.9 mttp -72.56 141.48 48.45 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.451 HG13 HD21 ' A' ' 181' ' ' LEU . 86.1 t -91.11 120.92 40.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -84.8 153.81 22.74 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-O 121.156 0.503 . . . . 0.0 111.381 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' VAL . . . . . 0.446 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.7 t -69.11 122.22 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.39 -14.77 35.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.399 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.33 127.13 31.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.947 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.9 m-20 -68.52 110.06 4.02 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.451 HD21 HG13 ' A' ' 175' ' ' VAL . 69.4 mt -96.36 149.23 21.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.79 0.805 . . . . 0.0 112.924 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.06 112.51 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.9 mp -92.96 135.64 33.97 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.14 -178.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.465 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.9 t -127.75 127.75 68.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.75 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -64.43 127.86 33.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -71.22 -31.82 45.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.698 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.0 t -80.08 -36.65 35.22 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 60.4 p -116.74 2.4 12.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.169 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 50.42 28.31 3.24 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 179.772 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 26.0 mtt180 -108.89 140.76 41.92 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.937 0.399 . . . . 0.0 110.99 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.3 m-85 -72.03 153.77 41.55 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.42 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 28.5 tp -75.31 76.72 2.41 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 105.253 -2.129 . . . . 0.0 105.253 175.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -76.82 149.66 36.18 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 115.454 1.649 . . . . 0.0 115.454 -174.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.1 tp -99.0 115.02 27.97 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 113.78 -1.554 . . . . 0.0 107.622 177.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.0 t -107.83 146.54 32.11 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -177.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -106.0 91.89 3.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.575 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.49 -175.07 47.05 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.36 -0.924 . . . . 0.0 111.507 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 79.6 m-20 -0.25 -78.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.379 0.671 . . . . 0.0 112.386 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 79.3 p -146.2 12.65 1.23 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.095 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 77.0 p -126.57 -178.54 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.868 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.617 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.6 m95 -107.81 136.3 47.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.223 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.575 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 14.0 m80 -129.15 173.27 10.63 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.949 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.45 131.27 71.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.204 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -147.72 170.19 18.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.544 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.61 94.19 6.84 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.216 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.79 176.5 4.99 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.09 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.32 7.96 20.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.1 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -114.43 136.37 53.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.733 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.81 174.52 1.82 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.45 1.119 . . . . 0.0 113.119 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.8 m -168.61 119.86 0.78 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 112.886 -1.961 . . . . 0.0 107.72 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 48.7 mt -73.68 129.8 38.69 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.956 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -116.89 138.5 51.49 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.738 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.7 m -105.44 100.65 10.22 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.711 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.796 HG22 ' HG ' ' A' ' 22' ' ' LEU . 87.4 t -91.96 101.58 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.777 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 215' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.89 142.32 28.22 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.196 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.446 ' HD3' HG13 ' A' ' 177' ' ' VAL . 27.0 Cg_exo -62.76 104.97 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.18 1.92 . . . . 0.0 111.116 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.504 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.5 mm . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.24 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.3 mt -81.04 122.72 27.66 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -110.0 156.83 19.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.063 0.459 . . . . 0.0 111.093 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.5 p -68.2 155.33 39.88 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.753 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 71.97 -4.03 2.06 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.753 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.46 134.43 45.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.623 179.403 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -81.26 120.98 25.59 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.473 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.84 171.61 15.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -177.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.497 HG11 HD11 ' A' ' 62' ' ' LEU . 3.2 m -132.82 137.4 54.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.349 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -98.11 124.87 42.86 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 66.1 mt-30 -125.64 143.32 51.08 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.439 0.638 . . . . 0.0 112.339 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -128.89 144.08 51.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.851 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -86.61 120.58 28.08 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.134 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.19 121.25 44.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.258 -179.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 m -124.5 137.63 54.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.622 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.8 tt -177.64 146.16 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.581 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 47.8 m80 58.97 40.12 22.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.183 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 60.64 22.03 11.9 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.283 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -126.46 138.4 53.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.452 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -126.65 147.63 49.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.974 0.416 . . . . 0.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -159.39 172.84 17.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.564 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -120.47 140.42 51.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.45 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -128.97 143.57 50.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.424 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.9 p -106.96 138.33 43.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.014 0.435 . . . . 0.0 110.722 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.549 ' HA ' HD23 ' A' ' 49' ' ' LEU . 29.5 tp -60.08 111.04 1.36 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.091 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.39 165.68 11.76 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.599 -179.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.87 163.36 13.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.811 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -134.67 145.35 48.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.522 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.92 12.18 58.18 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.782 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -121.14 151.39 39.96 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.926 0.393 . . . . 0.0 110.808 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.9 -137.34 18.52 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -83.31 8.99 11.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.789 0.328 . . . . 0.0 110.893 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.28 31.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.099 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.52 135.06 37.24 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 110.509 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.3 m -75.66 150.52 37.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.56 0.695 . . . . 0.0 111.297 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -144.03 -167.13 2.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 108.594 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 37' ' ' LEU . 29.8 mt -131.87 142.82 49.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.7 mt-10 . . . . . 0 CA--C 1.503 -0.856 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.794 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 HG11 ' A' ' 21' ' ' VAL . 48.3 tp . . . . . 0 C--O 1.231 0.091 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.2 m -53.14 -48.74 67.68 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.455 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -68.27 -17.68 22.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 61.2 m -99.92 13.75 32.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -92.01 130.97 37.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.567 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.7 159.12 42.84 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.259 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.562 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -123.51 133.68 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.606 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.9 mt -81.72 64.77 6.57 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.511 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.5 mm-40 -44.13 -61.28 1.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -178.281 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -125.21 165.4 18.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.706 0.765 . . . . 0.0 112.889 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -157.82 85.67 0.9 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.935 179.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -113.84 159.22 20.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.469 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.432 ' HB2' HH12 ' A' ' 76' ' ' ARG . 9.4 m -70.25 149.13 47.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 56.1 t -52.0 -45.05 40.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.004 0.43 . . . . 0.0 110.219 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.432 HH12 ' HB2' ' A' ' 74' ' ' SER . 1.9 tmm_? -57.37 -54.55 45.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.26 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.427 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -58.75 -44.96 90.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.909 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.6 tp -60.67 -47.17 87.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.444 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.868 0.365 . . . . 0.0 110.669 -179.864 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.824 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 2.2 mm-40 . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.791 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.824 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 56.2 mtpt -87.43 -51.85 5.7 Favored 'General case' 0 C--N 1.353 0.75 0 CA-C-N 120.324 1.42 . . . . 0.0 111.592 -3.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -66.31 -28.48 68.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.918 -1.492 . . . . 0.0 113.031 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.638 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.2 mptm? -60.29 -45.88 91.79 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.876 -0.729 . . . . 0.0 110.132 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' PHE . . . . . 0.659 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 22.6 t80 -74.14 -41.95 60.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.261 179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -56.83 -46.35 81.75 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.982 0.42 . . . . 0.0 110.557 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.1 tmm? -71.04 -41.98 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.736 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -57.47 -40.39 78.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.745 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 49.2 p -73.05 -52.71 13.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.273 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.71 -27.45 62.97 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.459 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.741 -179.921 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 121.144 0.497 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 98.0 m -79.56 146.74 32.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.16 131.92 35.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.826 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.28 141.98 47.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.041 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -62.32 126.07 26.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.093 0.473 . . . . 0.0 110.59 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.48 -11.34 50.61 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.053 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -84.07 141.26 31.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.06 126.97 32.61 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.2 pt -112.05 160.27 11.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.564 0.697 . . . . 0.0 112.777 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 153' ' ' THR . 20.3 tp -115.78 110.38 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.053 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.405 ' CD2' HD23 ' A' ' 69' ' ' LEU . 61.9 mt -98.4 116.51 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.641 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.562 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.1 ttp85 -102.81 116.38 32.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.62 179.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.7 t-80 -59.37 106.54 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 177.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.2 t -50.72 -45.65 58.64 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.454 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 37.5 t80 -65.27 -59.55 3.94 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.4 m -75.76 -16.42 60.13 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -3.35 48.49 Favored Glycine 0 N--CA 1.454 -0.159 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.379 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 61.9 mtm -84.76 -166.25 1.42 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.486 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.1 m-85 -131.67 140.53 49.36 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -177.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.416 HD13 HD21 ' A' ' 37' ' ' LEU . 27.8 tp -55.23 129.55 38.75 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.0 t -138.69 149.26 44.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.1 t -96.4 95.98 8.41 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 176.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.4 mt -71.85 154.53 41.2 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.412 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.2 m -83.96 3.58 33.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.048 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.1 p -90.8 127.19 36.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.717 0.294 . . . . 0.0 111.018 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.0 p . . . . . 0 C--N 1.327 -0.406 0 CA-C-O 120.846 0.355 . . . . 0.0 110.75 179.799 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.154 0.502 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.528 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 12.4 m-85 -98.12 167.2 11.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.264 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -87.05 145.51 26.44 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.041 0.448 . . . . 0.0 109.96 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 89.7 t -115.06 116.56 52.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.51 -151.62 6.25 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.705 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.5 mt -112.67 148.55 34.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.949 0.404 . . . . 0.0 110.737 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -137.77 140.19 40.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.87 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.5 -77.87 0.06 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.674 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.05 153.06 44.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 120' ' ' LEU . 73.2 p -104.3 4.02 33.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.099 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.4 p -56.2 115.46 2.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.67 -162.29 16.53 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.636 -0.792 . . . . 0.0 111.741 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' GLU . . . . . 0.536 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.1 mt-10 -118.97 -9.96 9.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.707 0.289 . . . . 0.0 111.39 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.93 -31.13 68.39 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -91.18 8.1 37.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.583 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.6 133.09 54.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.458 . . . . 0.0 111.183 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' TRP . . . . . 0.469 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.8 m95 -128.57 117.41 21.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.779 -178.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 10.7 p -79.2 125.99 30.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.136 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 162' ' ' ILE . . . . . 0.508 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -87.69 136.41 23.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.928 0.394 . . . . 0.0 110.938 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -128.6 150.94 76.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.087 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.716 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.0 Cg_endo -67.84 140.92 52.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.488 2.125 . . . . 0.0 112.286 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.87 -46.22 54.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.809 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.457 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 58.9 m -112.92 -171.09 1.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.44 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 167' ' ' LYS . . . . . 0.483 ' HG3' ' NE2' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -88.51 8.27 28.9 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.235 -179.624 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.483 ' NE2' ' HG3' ' A' ' 167' ' ' LYS . 8.7 mm-40 -81.36 -37.8 27.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.059 0.457 . . . . 0.0 110.567 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.716 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 78.4 mmt-85 -91.82 150.46 21.06 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.402 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 44.9 t -128.46 166.53 18.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.136 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 128.54 36.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.309 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 98.3 -16.39 60.03 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.877 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -69.1 156.38 38.77 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.929 0.395 . . . . 0.0 111.201 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -72.95 143.48 47.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 162' ' ' ILE . 93.0 t -93.43 118.89 40.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.458 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -83.39 155.34 23.54 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.322 0.582 . . . . 0.0 111.563 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 30.7 t -69.46 120.95 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 176.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -15.13 33.19 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.379 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -65.68 128.76 37.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.697 0.284 . . . . 0.0 110.732 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 180' ' ' ASP . . . . . 0.451 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 3.9 m-20 -69.76 111.17 5.34 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 181' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 175' ' ' VAL . 76.8 mt -97.27 148.73 22.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 182' ' ' ILE . . . . . 0.506 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.6 mt -114.65 112.02 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 183' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -91.89 138.24 31.71 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.141 0.496 . . . . 0.0 112.108 -178.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 184' ' ' VAL . . . . . 0.495 HG22 ' CD1' ' A' ' 191' ' ' TYR . 88.9 t -129.15 128.21 66.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.797 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -65.48 127.36 31.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 87.8 t -71.93 -33.35 47.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.637 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.7 p -80.42 -36.02 34.29 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 188' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 63.2 m -114.83 2.41 14.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 189' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 49.31 29.02 2.53 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 190' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.3 mtt180 -111.63 140.19 46.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 110.87 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 191' ' ' TYR . . . . . 0.495 ' CD1' HG22 ' A' ' 184' ' ' VAL . 52.0 m-85 -71.11 155.12 41.14 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.7 tp -75.52 75.83 2.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 193' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.4 t60 -75.46 150.09 38.33 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -174.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.5 tp -100.21 112.6 24.93 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 113.649 -1.614 . . . . 0.0 107.639 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 195' ' ' SER . . . . . 0.407 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 62.9 p -105.0 145.69 30.08 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.23 91.36 3.76 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 197' ' ' GLY . . . . . 0.546 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.69 -174.49 44.6 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.511 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 11.9 m-80 -0.42 -78.92 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.302 0.641 . . . . 0.0 112.366 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 50.4 m -146.93 13.19 1.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.927 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.8 p -126.61 -177.81 4.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.917 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 201' ' ' TRP . . . . . 0.643 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.6 m95 -108.56 135.09 50.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.314 0.578 . . . . 0.0 111.341 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 202' ' ' HIS . . . . . 0.546 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 12.2 m80 -128.33 174.11 9.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.4 p -126.78 132.14 70.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 52.0 p-10 -150.09 167.11 27.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.715 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 205' ' ' ALA . . . . . 0.486 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.32 95.27 8.79 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.32 173.64 6.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.339 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -81.55 8.01 10.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 208' ' ' GLN . . . . . 0.473 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 74.9 mm-40 -114.67 137.42 51.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.731 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 209' ' ' GLN . . . . . 0.506 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.7 mt-30 -66.13 174.82 2.36 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 122.279 1.038 . . . . 0.0 112.809 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.0 m -168.01 121.02 0.89 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.186 -1.824 . . . . 0.0 107.945 178.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 211' ' ' LEU . . . . . 0.451 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 68.4 mt -75.37 128.06 34.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.98 0.419 . . . . 0.0 109.967 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.64 145.77 42.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.9 m -114.01 102.36 10.11 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.206 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 214' ' ' VAL . . . . . 0.747 HG22 ' HG ' ' A' ' 22' ' ' LEU . 80.4 t -93.39 105.55 16.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.041 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 215' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -116.69 141.4 28.07 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.247 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.5 Cg_exo -64.31 104.73 0.53 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.194 1.929 . . . . 0.0 111.192 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 217' ' ' ILE . . . . . 0.473 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.986 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 23.7 mm-40 . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.429 ' HB3' HG23 ' A' ' 112' ' ' THR . 44.4 m-85 -119.19 153.14 35.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.913 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.79 126.09 30.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.435 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 10.5 mmm180 -112.83 156.59 22.63 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.096 0.475 . . . . 0.0 111.226 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 p -67.46 156.09 37.44 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.801 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 70.92 -2.84 2.18 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.856 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.1 m-20 -73.25 133.82 44.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.6 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -80.8 120.49 24.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -136.42 171.98 16.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.568 HG11 HD11 ' A' ' 62' ' ' LEU . 3.3 m -133.09 135.79 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 114.682 -1.145 . . . . 0.0 108.239 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -96.85 123.65 40.61 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.563 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 22.3 mt-30 -120.42 163.05 18.48 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.4 0.619 . . . . 0.0 111.359 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -150.96 139.43 20.48 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.422 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -83.81 121.41 27.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.513 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.612 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.67 119.09 35.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.968 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.4 m -122.91 136.9 55.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.002 0.43 . . . . 0.0 111.695 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.6 tt -171.49 145.32 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.3 m80 59.29 37.84 23.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.42 22.52 13.29 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.503 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.62 131.93 49.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.405 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -118.81 144.42 46.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.025 0.44 . . . . 0.0 111.41 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -154.03 171.93 18.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.631 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -119.41 141.14 49.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.429 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.7 mt -130.23 141.97 50.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.469 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.8 p -106.38 138.19 43.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.022 0.439 . . . . 0.0 110.531 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.6 tp -60.02 110.46 1.2 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.187 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.454 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.83 165.15 11.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.518 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.92 167.14 9.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.801 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.02 150.62 44.64 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.537 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.11 -2.64 89.34 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.967 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -108.84 156.07 20.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 111.025 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.09 -141.6 23.41 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.276 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -81.07 7.88 9.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.753 0.311 . . . . 0.0 110.623 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.11 30.04 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.847 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.26 139.58 38.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.007 0.432 . . . . 0.0 110.415 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.5 m -80.15 150.5 30.17 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.545 0.688 . . . . 0.0 111.208 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -145.04 -168.6 2.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.658 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.8 mt -128.64 143.86 51.04 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.445 0.64 . . . . 0.0 112.031 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -110.63 139.08 46.22 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.809 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.514 ' HA ' HD23 ' A' ' 35' ' ' LEU . 47.3 t -77.57 140.13 39.65 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 176.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 72.1 p -109.54 172.75 6.67 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.178 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.743 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 47.0 t 18.1 59.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.579 -1.191 . . . . 0.0 112.814 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -102.08 -25.25 13.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.365 0.602 . . . . 0.0 109.614 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.528 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 69.4 p -164.69 67.95 0.15 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.225 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.528 ' HA ' ' N ' ' A' ' 55' ' ' SER . 24.1 pttm -149.1 39.98 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 122.692 0.397 . . . . 0.0 111.501 0.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.443 ' N ' ' HA ' ' A' ' 53' ' ' SER . 59.9 t30 -172.1 123.37 0.5 Allowed 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.759 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 60.88 166.01 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.51 178.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.759 ' HD2' HG22 ' A' ' 58' ' ' VAL . 18.6 Cg_endo -62.76 138.93 72.01 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.167 1.911 . . . . 0.0 111.971 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.413 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.9 Cg_endo -54.26 -40.02 84.15 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.299 1.999 . . . . 0.0 111.128 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.406 ' O ' HG12 ' A' ' 64' ' ' ILE . 10.7 t70 -122.2 87.61 2.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.715 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.568 HD11 HG11 ' A' ' 21' ' ' VAL . 52.1 tp -70.08 -25.82 63.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.134 -178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t -55.67 -47.22 77.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.454 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.7 pt -68.78 -16.76 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 67.6 m -101.3 13.76 34.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.889 0.376 . . . . 0.0 110.826 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.5 m -91.56 130.18 37.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.717 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -136.78 159.94 40.34 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.097 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.593 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -124.09 132.03 71.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.654 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.5 mt -79.92 65.73 5.17 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.496 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.6 mm-40 -44.53 -64.53 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.469 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -122.81 165.35 16.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 112.963 -177.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.9 m -156.89 86.51 0.98 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.022 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.2 mt -114.22 158.23 21.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.472 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.8 t -70.24 148.19 48.86 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 177.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.407 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.6 t -51.33 -45.1 32.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -57.82 -52.77 64.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.093 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -61.7 -43.13 99.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.9 tp -61.47 -48.23 82.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.199 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 92.9 mt-30 -65.17 -34.33 78.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.67 -44.14 87.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.772 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.9 mtt -60.8 -46.8 89.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.875 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.64 -33.75 76.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.002 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.44 -35.24 77.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.817 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.19 -18.13 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.444 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.5 p -90.8 1.9 56.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.523 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.462 HG12 ' HG3' ' A' ' 87' ' ' GLU . 23.3 t -80.06 -60.47 2.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.87 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.462 ' HG3' HG12 ' A' ' 86' ' ' VAL . 44.9 mt-10 -147.48 90.3 1.85 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -168.98 129.33 1.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.736 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.5 m -77.57 -28.38 51.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.846 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -87.83 172.69 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.722 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.52 32.88 4.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.847 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -97.25 116.44 29.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.717 0.294 . . . . 0.0 110.825 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.488 ' HB ' HG21 ' A' ' 104' ' ' THR . 26.7 m -76.45 -24.47 15.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.277 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -112.24 86.02 2.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.541 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 39.2 t -86.11 -27.02 6.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.742 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 9.9 tp10 -57.96 -41.38 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.124 0.786 . . . . 0.0 113.124 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.742 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.1 pttm -80.74 -26.06 37.62 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.525 1.53 . . . . 0.0 112.698 -0.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -52.16 -57.46 9.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.66 ' H ' ' HG2' ' A' ' 96' ' ' GLU . 1.7 tmtp? -57.08 -52.39 65.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.347 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.432 ' HB2' ' H ' ' A' ' 96' ' ' GLU . 28.9 m-85 -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.871 0.367 . . . . 0.0 110.599 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 28.3 ttt -71.31 -40.41 70.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.802 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 24.1 ttt -68.35 -35.75 78.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.66 -44.64 70.11 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.479 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.488 HG21 ' HB ' ' A' ' 93' ' ' VAL . 29.2 p -65.93 -38.44 88.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.186 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -68.72 -44.86 72.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -74.84 -23.21 58.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.734 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.39 -33.1 23.57 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.676 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.22 -98.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.576 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.658 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . 159.93 177.3 32.9 Favored Glycine 0 CA--C 1.523 0.539 0 CA-C-O 119.287 -0.729 . . . . 0.0 112.241 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.658 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 35.6 m-70 55.99 70.32 0.65 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.075 1.438 . . . . 0.0 112.146 0.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -149.18 143.85 26.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.123 0.487 . . . . 0.0 111.157 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.429 HG23 ' HB3' ' A' ' 13' ' ' PHE . 87.8 m -74.03 146.27 43.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.96 133.77 35.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.701 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.5 mt -117.01 141.83 47.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.243 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -61.89 129.7 42.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.067 0.46 . . . . 0.0 110.463 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -12.09 58.05 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.117 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.44 140.75 32.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.096 0.474 . . . . 0.0 111.513 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.28 126.79 32.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.142 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 160' ' ' TRP . 48.2 pt -111.97 159.54 11.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.471 0.653 . . . . 0.0 112.746 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.469 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.2 tp -114.51 108.8 17.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.889 -1.051 . . . . 0.0 109.895 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.408 ' CD2' HD23 ' A' ' 69' ' ' LEU . 67.0 mt -97.01 116.72 29.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.703 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.593 ' NH2' HG21 ' A' ' 68' ' ' VAL . 48.8 ttp85 -102.87 116.49 32.66 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.665 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.2 t-80 -59.47 106.55 0.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 43.1 t -49.76 -47.38 50.97 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 57.5 t80 -64.26 -61.23 2.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.8 t -74.26 -16.83 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.43 -2.77 51.59 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.379 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.2 mtt -83.46 -165.55 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.469 0.176 . . . . 0.0 110.626 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.7 m-85 -133.7 138.86 46.07 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.8 tp -55.65 125.54 21.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.587 ' SG ' HD21 ' A' ' 133' ' ' LEU . 17.7 p -136.26 147.71 47.67 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.4 t -93.15 98.6 11.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.587 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.7 mt -75.53 146.65 40.35 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.374 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -77.95 5.9 8.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.019 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.3 p -97.95 120.56 38.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 66.5 m -74.92 -60.23 2.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.918 0.389 . . . . 0.0 110.264 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.424 ' HB2' ' OD2' ' A' ' 146' ' ' ASP . 19.5 mmm180 54.54 31.49 15.01 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.332 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.0 m -136.36 -30.48 0.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.865 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.6 t -166.77 166.91 15.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.961 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.0 p -91.37 -3.9 56.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.098 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.58 -0.45 53.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm 57.04 33.34 23.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.565 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -74.19 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.831 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -113.11 151.51 30.73 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.504 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 11.6 m-85 -100.91 173.32 6.54 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.043 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ASP . . . . . 0.424 ' OD2' ' HB2' ' A' ' 137' ' ' ARG . 43.4 m-20 -92.51 145.13 24.69 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 93.3 t -114.33 116.1 51.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.174 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.54 -152.82 6.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.002 -1.094 . . . . 0.0 113.246 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 52.4 mt -113.22 143.44 44.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.823 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -129.37 141.13 51.14 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.831 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.85 -52.71 13.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.487 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.504 ' HB3' HG22 ' A' ' 154' ' ' THR . 7.5 m-20 -87.66 151.36 23.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.691 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 67.2 p -104.96 -6.34 20.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.823 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' THR . . . . . 0.504 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.37 115.59 2.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.467 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.14 -159.22 19.73 Favored Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.654 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.507 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -120.53 -13.9 8.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.719 0.295 . . . . 0.0 111.416 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.83 -33.35 66.68 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.6 m -88.62 6.22 39.28 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -110.02 133.75 52.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.146 0.498 . . . . 0.0 111.418 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.485 ' O ' HG12 ' A' ' 119' ' ' ILE . 56.6 m95 -128.56 117.54 21.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.715 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.427 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 14.4 p -79.1 127.64 32.27 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.095 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -89.64 134.83 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.4 m-70 -128.61 151.72 77.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.262 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.705 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.1 Cg_endo -67.85 140.73 51.62 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.5 2.134 . . . . 0.0 112.515 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.83 -44.19 42.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 52.1 m -109.29 -173.64 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.132 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.569 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -90.46 6.15 44.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.147 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.569 HE22 ' HE2' ' A' ' 167' ' ' LYS . 10.5 mm-40 -80.58 -36.53 32.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.488 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.705 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 65.5 mmt-85 -90.0 148.16 23.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.229 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.4 m -127.99 166.8 17.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 111.382 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -66.64 133.81 51.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.235 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.96 -16.91 58.38 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.087 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -67.49 157.3 34.6 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.016 0.436 . . . . 0.0 111.313 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -74.36 140.53 44.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.238 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 88.0 t -90.23 119.84 38.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.371 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.433 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 25.7 mmt180 -83.61 154.85 23.53 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-O 121.283 0.564 . . . . 0.0 111.406 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 31.6 t -69.55 120.47 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.94 -7.81 35.95 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.376 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -71.45 129.33 38.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 110.853 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.555 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.2 m-20 -70.8 109.84 5.23 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.432 HD21 HG13 ' A' ' 175' ' ' VAL . 63.9 mt -97.14 149.67 21.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.759 0.79 . . . . 0.0 113.035 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 52.8 mt -114.46 112.94 42.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.83 136.7 33.01 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.161 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.45 HG22 ' CD1' ' A' ' 191' ' ' TYR . 74.1 t -128.73 123.13 58.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.735 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 91.4 p -62.5 125.59 24.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 80.1 t -68.7 -32.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.166 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 89.5 p -77.52 -38.49 48.74 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 41.2 t -115.59 2.95 13.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.38 27.17 3.51 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 20.9 mtt180 -107.79 142.5 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.974 0.416 . . . . 0.0 110.927 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.1 m-85 -73.74 154.9 39.41 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.421 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.0 tp -76.42 76.56 3.16 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.0 t60 -76.81 149.41 36.22 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 115.644 1.72 . . . . 0.0 115.644 -174.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -98.7 119.58 37.68 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.639 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.8 p -113.79 144.37 43.1 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -103.81 92.23 4.33 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.521 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -81.82 -176.86 51.44 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.321 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.521 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.3 m-20 4.28 -80.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.406 0.682 . . . . 0.0 112.449 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 37.5 t -145.24 8.2 1.2 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.019 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 57.3 m -122.39 -177.84 3.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.612 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -108.01 138.14 44.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.169 0.509 . . . . 0.0 111.129 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.514 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 17.4 m80 -129.79 173.05 11.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.216 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.58 133.38 67.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.23 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.7 171.22 17.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.71 94.94 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.03 173.29 6.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.005 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -82.41 10.56 6.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.413 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 71.4 mt-30 -116.43 137.64 52.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.523 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -67.12 174.91 2.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 122.297 1.046 . . . . 0.0 113.303 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.4 m -169.16 121.7 0.77 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 112.931 -1.94 . . . . 0.0 107.812 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.4 mt -74.74 130.58 39.73 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.018 0.437 . . . . 0.0 109.838 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -118.52 133.08 56.15 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.083 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 52.2 m -99.78 102.17 13.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.998 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 89.3 t -93.26 102.89 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.13 139.76 24.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.452 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.8 Cg_exo -63.8 105.82 0.58 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.134 1.889 . . . . 0.0 111.174 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.485 HG23 HD21 ' A' ' 62' ' ' LEU . 1.5 mm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.022 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.788 0.328 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -120.18 157.6 28.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.448 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.15 121.91 26.7 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.48 157.2 19.2 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.104 0.478 . . . . 0.0 111.17 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -67.89 156.03 38.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.586 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 16' ' ' THR . 14.3 m-20 70.99 -3.29 2.06 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.89 -179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.9 m-20 -73.58 133.23 43.48 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -79.69 119.18 22.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.481 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -135.02 174.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.655 HG11 HD11 ' A' ' 62' ' ' LEU . 3.7 m -134.0 140.94 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.367 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -102.64 116.64 32.99 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.789 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 62.1 mt-30 -119.15 138.42 52.94 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.453 0.644 . . . . 0.0 112.259 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.0 p -123.06 143.8 49.72 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.648 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.7 m -84.35 123.18 29.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.391 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.563 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.59 122.04 45.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.338 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.1 m -125.01 136.21 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.62 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.3 tt -172.75 144.5 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.366 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.0 m80 58.59 37.5 25.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.918 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.441 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.76 26.21 15.5 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.327 179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -128.18 132.61 48.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.33 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -122.77 145.17 48.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.076 0.465 . . . . 0.0 111.396 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.39 178.62 10.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.783 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -124.14 137.41 54.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.513 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.94 132.15 50.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.808 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.8 p -94.11 145.83 24.4 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.418 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.2 tp -69.2 108.94 3.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.081 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -106.18 164.0 12.35 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.305 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.93 164.71 13.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.44 140.86 39.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.659 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.01 17.25 28.36 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.246 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -121.29 146.11 47.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.691 0.282 . . . . 0.0 110.469 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.12 -135.15 14.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.371 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -84.02 9.16 13.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 110.996 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.06 33.63 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.222 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 25.4 mt -79.94 136.15 36.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.976 0.417 . . . . 0.0 110.652 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.9 m -76.9 151.28 35.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.539 0.685 . . . . 0.0 111.219 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -146.02 -170.74 3.55 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.736 -1.12 . . . . 0.0 108.538 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.3 mt -126.41 145.75 50.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.483 0.659 . . . . 0.0 112.06 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -114.69 138.87 50.18 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.549 -179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.432 ' HA ' HD23 ' A' ' 35' ' ' LEU . 45.4 t -75.89 140.59 42.25 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 68.3 p -109.89 175.56 5.39 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.145 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.704 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 46.1 t 18.19 60.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.936 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -107.23 -20.76 13.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.799 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.483 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 46.0 t -166.28 69.47 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.444 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.483 ' HA ' ' N ' ' A' ' 55' ' ' SER . 6.6 ptpp? -141.67 31.24 1.66 Allowed 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 122.963 0.505 . . . . 0.0 111.191 0.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.406 ' HA ' ' CB ' ' A' ' 53' ' ' SER . 21.7 p-10 -170.72 129.57 0.81 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.276 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.759 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 61.27 166.16 0.1 OUTLIER Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.271 178.867 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.759 ' HD2' HG22 ' A' ' 58' ' ' VAL . 17.9 Cg_endo -63.62 139.11 68.07 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.25 1.966 . . . . 0.0 112.166 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.402 ' HD2' ' O ' ' A' ' 51' ' ' SER . 11.1 Cg_endo -55.1 -39.2 92.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.334 2.022 . . . . 0.0 111.159 179.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -121.96 89.21 3.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.726 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.655 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp -71.56 -29.01 64.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.202 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.9 m -51.25 -44.43 61.73 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.497 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.8 pt -72.46 -20.83 19.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.4 m -98.94 13.18 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.75 0.31 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -89.25 129.56 35.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.133 0.492 . . . . 0.0 111.896 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -136.58 162.19 33.8 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.907 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.594 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.9 132.35 70.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.698 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 16.6 mt -80.47 66.7 6.07 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.519 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.3 mm-40 -46.75 -61.91 1.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -122.58 163.05 20.68 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.793 0.806 . . . . 0.0 112.899 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.6 t -156.1 83.33 1.0 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.819 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 mt -113.17 153.75 27.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.557 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.1 t -67.8 147.12 53.0 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 52.6 t -48.79 -44.64 15.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.106 0.479 . . . . 0.0 110.352 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -57.54 -53.7 55.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.225 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.63 -43.37 97.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.787 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.48 -46.68 89.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.349 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 49.8 mt-30 -66.23 -34.83 78.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.807 0.337 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.9 mtt -63.81 -44.24 93.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.695 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 86' ' ' VAL . 81.4 mt -69.41 -35.03 75.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.81 -35.52 78.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.156 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.6 -24.37 64.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.675 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.6 p -84.22 -5.72 59.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.703 0.287 . . . . 0.0 111.523 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 82' ' ' LEU . 45.3 t -87.69 -53.33 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.279 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.57 -88.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.159 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -148.66 -63.34 0.24 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.894 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.3 t 61.07 176.32 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.212 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -106.12 -9.37 16.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.912 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.66 31.66 81.53 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.752 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 62.49 -82.75 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.441 0.162 . . . . 0.0 111.346 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t 64.0 119.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -79.61 78.24 6.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.045 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.435 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 10.9 p -83.55 -1.3 5.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.455 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.8 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 4.8 mm-40 -53.58 -40.69 65.85 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.8 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 34.2 mtmm -87.17 -51.14 6.16 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 125.059 1.344 . . . . 0.0 111.652 -2.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -58.99 -33.89 71.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.141 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.696 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 32.3 mtmm -62.86 -36.56 83.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.358 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.775 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 37.1 t80 -74.15 -48.0 32.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.885 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.7 ttt -58.31 -37.29 74.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.608 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 45.7 ttm -73.0 -43.86 61.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.827 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.28 -44.14 88.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.915 0.388 . . . . 0.0 110.744 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.2 p -71.29 -40.56 70.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.42 33.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.938 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -62.94 -47.15 84.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.89 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.75 -27.12 70.62 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.609 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -71.66 104.91 1.54 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.564 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.708 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . -77.24 177.85 52.11 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.411 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.708 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 77.2 m-70 55.1 32.37 18.17 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.953 1.377 . . . . 0.0 112.29 0.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -107.54 148.13 29.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.072 0.463 . . . . 0.0 111.477 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.0 m -78.71 148.2 33.16 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.124 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.19 132.47 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.672 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.2 mt -116.89 143.78 45.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.215 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -63.88 133.74 53.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.09 0.472 . . . . 0.0 110.469 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.89 -12.44 64.14 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.996 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.98 139.9 33.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.069 0.462 . . . . 0.0 111.509 -179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -82.13 126.51 32.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.7 pt -111.45 160.93 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.536 0.684 . . . . 0.0 112.773 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.432 HD21 HG21 ' A' ' 153' ' ' THR . 20.1 tp -116.97 108.97 16.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.866 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.411 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -96.44 117.72 31.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.613 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.594 ' NH2' HG21 ' A' ' 68' ' ' VAL . 46.8 ttp85 -103.25 116.77 33.09 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.758 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.1 t-80 -59.98 106.48 0.51 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 40.3 t -50.76 -44.99 58.68 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.491 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 49.2 t80 -64.85 -60.58 2.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.477 ' OG ' HD13 ' A' ' 149' ' ' LEU . 58.3 p -77.1 -14.53 59.79 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.26 -0.29 48.67 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.233 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -83.78 -165.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -134.42 140.33 46.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 25.9 tp -55.12 125.91 22.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.2 t -135.2 149.39 49.9 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.1 t -95.91 97.79 9.91 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.6 mt -74.18 151.26 40.04 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.681 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 76.2 p -80.79 6.06 14.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.866 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 77.5 p -93.66 123.03 36.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.0 110.986 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t -65.9 -60.43 2.87 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.806 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -172.09 -78.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.1 m -158.85 -30.2 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.972 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.9 m -87.78 179.9 6.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.044 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 75.5 p -73.42 -18.97 61.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.94 146.83 53.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.734 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -112.78 -89.45 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.33 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 55.32 -89.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.005 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.03 148.0 23.44 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.296 0.57 . . . . 0.0 111.633 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.8 m-85 -99.41 169.82 9.06 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.218 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -89.23 140.74 29.18 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.712 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.0 t -110.39 117.66 55.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.57 -147.81 5.76 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.73 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 77.2 mt -117.93 148.6 42.02 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.935 0.397 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -141.67 139.38 32.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.803 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.1 -72.91 0.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.16 149.29 45.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.432 HG21 HD21 ' A' ' 120' ' ' LEU . 73.9 p -109.98 -2.8 16.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.205 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.2 p -54.84 116.81 2.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.69 -159.36 18.32 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.591 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.545 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.4 mt-10 -120.42 -10.06 9.35 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.809 0.338 . . . . 0.0 111.141 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.03 -31.95 67.5 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.8 m -93.93 9.52 37.1 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -110.49 131.48 55.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.094 0.473 . . . . 0.0 111.409 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.472 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.7 m95 -126.7 116.43 20.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.579 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 9.6 p -78.93 127.39 31.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.24 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.518 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.72 135.21 26.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.405 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 84.5 m-70 -128.22 150.17 73.28 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.158 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.6 Cg_endo -67.36 139.85 51.01 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.668 2.245 . . . . 0.0 112.153 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.25 -44.93 58.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.697 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.422 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 51.0 m -110.98 -171.83 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.249 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 11.26 25.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.227 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.422 ' HG2' ' HB2' ' A' ' 166' ' ' SER . 2.1 mm100 -84.74 -34.59 22.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.112 0.482 . . . . 0.0 110.437 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.708 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.5 mmp_? -92.57 147.21 23.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.14 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 31.3 t -126.52 166.46 17.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.826 0.346 . . . . 0.0 111.298 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.5 OUTLIER -65.56 131.66 46.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.463 179.769 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.87 -14.13 65.9 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.146 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.6 mt-10 -70.51 154.86 41.43 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 111.134 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -70.75 143.75 51.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.518 HG21 HD12 ' A' ' 162' ' ' ILE . 98.2 t -94.02 110.86 24.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.432 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -73.71 153.04 40.23 Favored 'General case' 0 CA--C 1.5 -0.974 0 CA-C-O 121.308 0.575 . . . . 0.0 111.409 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 38.7 t -68.69 121.4 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 176.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.4 -15.26 32.69 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.172 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.05 127.58 32.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 120.833 0.349 . . . . 0.0 110.9 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -68.92 112.25 5.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.484 HD21 HG13 ' A' ' 175' ' ' VAL . 65.3 mt -98.77 149.02 23.3 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.836 0.827 . . . . 0.0 113.166 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.473 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.8 mt -114.57 112.97 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.97 138.98 31.0 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.1 0.476 . . . . 0.0 111.988 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.468 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.9 t -130.77 123.27 54.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.0 t -63.04 122.09 15.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.545 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 79.2 t -65.44 -34.46 70.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 120.806 0.336 . . . . 0.0 111.253 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.9 p -78.03 -39.65 41.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.495 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 49.2 m -113.22 9.63 18.44 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.506 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.56 30.7 0.37 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.718 0.636 . . . . 0.0 112.587 179.257 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.506 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 32.5 mtt85 -111.79 141.4 45.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.939 -179.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 61.3 m-85 -73.0 153.41 40.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.8 tp -75.61 75.65 2.62 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 175.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.407 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 80.8 t60 -75.2 151.63 38.45 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -174.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.9 tp -101.43 119.44 38.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.559 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 35.5 p -113.51 146.73 39.17 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.09 89.61 3.12 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.58 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.23 -174.75 43.88 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.214 -0.994 . . . . 0.0 111.515 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.6 m-80 1.11 -78.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.421 0.688 . . . . 0.0 112.417 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 48.9 m -147.09 10.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.099 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.6 p -125.37 -178.85 4.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.941 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.563 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.0 m95 -107.49 135.3 49.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.273 0.559 . . . . 0.0 111.175 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.58 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 16.0 m80 -126.95 172.72 10.21 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.23 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.32 132.8 70.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.121 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.74 170.52 19.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.549 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.38 96.34 8.3 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.38 -179.46 3.64 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.403 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.6 8.36 28.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.283 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.407 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 82.2 mt-30 -117.21 137.28 52.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.569 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.473 ' NE2' HD13 ' A' ' 182' ' ' ILE . 94.4 mt-30 -64.63 174.51 1.75 Allowed 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 122.295 1.045 . . . . 0.0 112.949 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 210' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.3 m -166.58 121.16 1.11 Allowed 'General case' 0 N--CA 1.44 -0.975 0 CA-C-N 113.13 -1.85 . . . . 0.0 107.994 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.3 mt -74.99 128.94 36.76 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.055 0.455 . . . . 0.0 109.89 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.9 m95 -116.53 147.83 41.42 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.456 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 53.1 m -114.86 99.77 7.73 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.462 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.741 HG22 ' HG ' ' A' ' 22' ' ' LEU . 74.0 t -92.09 101.12 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.842 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.415 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -115.58 142.31 28.68 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.056 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.427 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.42 104.32 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.2 1.933 . . . . 0.0 110.995 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.481 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.211 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.4 ' N ' HH11 ' A' ' 176' ' ' ARG . 6.2 tp-100 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.749 0.309 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -119.35 153.64 34.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.25 123.35 27.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 10.5 mmm180 -111.56 156.38 21.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.162 0.505 . . . . 0.0 111.396 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 110' ' ' HIS . 7.6 p -67.35 156.62 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.611 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 16' ' ' THR . 8.5 m-20 71.39 -5.05 1.68 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.8 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.2 m-20 -72.68 133.84 44.8 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.684 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.64 121.74 26.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.512 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.24 172.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -177.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.572 HG11 HD11 ' A' ' 62' ' ' LEU . 3.5 m -133.32 136.28 55.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.545 -1.207 . . . . 0.0 108.222 176.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.74 121.96 40.27 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.557 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.458 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.2 mt-30 -118.96 161.31 20.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.375 0.607 . . . . 0.0 111.425 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.94 140.82 24.79 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.497 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.3 m -84.21 120.34 26.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.419 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.61 120.79 42.14 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.01 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.9 m -125.4 129.66 50.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.599 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.51 HG23 ' CD2' ' A' ' 29' ' ' HIS . 15.7 tt -165.21 146.28 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.624 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.51 ' CD2' HG23 ' A' ' 28' ' ' ILE . 43.6 m-70 58.47 44.44 18.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.225 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.447 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 60.27 22.23 11.66 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.854 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -127.62 147.5 50.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.482 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -132.75 148.5 52.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.957 0.408 . . . . 0.0 111.179 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -159.47 173.11 16.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -120.66 137.06 54.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.447 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.493 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.9 mt -126.24 141.72 51.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.9 p -104.73 141.83 35.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.022 0.439 . . . . 0.0 110.387 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.3 tp -64.31 109.26 1.84 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.121 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.468 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -107.11 162.69 13.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.545 -179.276 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.48 164.52 14.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.65 143.21 35.02 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.679 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.84 12.36 42.53 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.267 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -116.72 150.15 38.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.662 0.268 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.88 -138.34 19.27 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.317 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.6 p30 -84.69 11.93 8.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.661 0.267 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.96 29.55 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.269 179.537 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.65 140.85 38.34 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 120.975 0.417 . . . . 0.0 110.626 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.46 152.56 26.05 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.557 0.694 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -146.49 -169.19 3.21 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.581 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -128.06 143.8 51.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.423 0.63 . . . . 0.0 111.964 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -111.98 140.87 46.29 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.651 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.493 ' HA ' HD23 ' A' ' 35' ' ' LEU . 86.0 p -78.54 141.71 37.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 69.1 p -109.36 173.59 6.25 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.219 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.679 ' HB3' ' H ' ' A' ' 58' ' ' VAL . 83.1 p 18.3 59.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.706 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -103.38 -39.29 6.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.766 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.523 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 35.7 t -168.74 66.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.523 ' HA ' ' N ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -156.4 155.94 33.0 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.025 0.53 . . . . 0.0 110.979 0.11 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' N ' ' HA ' ' A' ' 53' ' ' SER . 6.6 t30 65.98 118.45 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.013 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.768 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 61.2 165.62 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.643 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.768 ' HD2' HG22 ' A' ' 58' ' ' VAL . 18.1 Cg_endo -64.1 138.05 60.05 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.326 2.017 . . . . 0.0 112.044 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.445 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.2 Cg_endo -52.84 -37.86 77.56 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.29 1.993 . . . . 0.0 111.399 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.433 ' O ' HG12 ' A' ' 64' ' ' ILE . 12.8 t70 -124.35 89.06 3.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.658 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.572 HD11 HG11 ' A' ' 21' ' ' VAL . 42.9 tp -72.32 -27.92 62.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.469 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.9 p -53.64 -42.71 68.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.468 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.3 pt -72.18 -17.72 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.5 m -101.92 14.27 32.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.651 0.262 . . . . 0.0 111.226 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.1 m -90.67 128.94 36.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.079 0.466 . . . . 0.0 111.719 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -136.35 159.38 41.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.984 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.561 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.2 t -123.23 132.56 71.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.716 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.06 65.87 5.36 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.2 mm-40 -45.24 -67.09 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.476 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 7.9 mm100 -118.99 164.48 15.41 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.687 0.756 . . . . 0.0 112.82 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.1 t -157.21 82.59 0.92 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.864 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.62 157.37 19.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.419 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.0 t -69.68 146.82 51.29 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.6 t -49.38 -46.06 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 16.8 ttp-105 -55.24 -58.53 7.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.097 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -55.05 -46.54 75.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.923 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.3 tp -58.78 -49.32 78.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.243 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 94.7 mt-30 -64.18 -33.21 75.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.754 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -66.99 -42.25 85.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.765 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.8 mtt -63.03 -43.73 97.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.905 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.7 mt -69.71 -35.24 74.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.82 -31.67 71.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.187 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.3 -27.37 63.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.496 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 60.3 p -78.1 -10.09 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.77 0.319 . . . . 0.0 111.387 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.8 t -76.79 -21.32 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.663 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -129.77 -166.87 1.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.501 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -57.74 118.76 5.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.822 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 79.3 p -141.02 147.97 39.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.984 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -168.47 115.48 0.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.76 36.99 0.74 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.603 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -78.06 -34.9 50.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.776 0.322 . . . . 0.0 110.971 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 24.0 m -79.24 -170.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.357 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 100' ' ' PHE . 3.9 p-10 -62.32 92.37 0.04 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.42 1.66 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.887 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.781 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.0 mm-40 -53.49 -41.52 66.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.34 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.1 mttt -88.41 -51.37 5.77 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 125.005 1.322 . . . . 0.0 111.225 -3.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -63.2 -28.36 69.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.724 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 23.9 tptm -63.31 -40.76 98.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.119 -0.633 . . . . 0.0 109.912 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.644 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.4 t80 -74.26 -44.12 54.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.949 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.58 -41.28 76.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.391 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.4 tpt -74.97 -41.15 60.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.992 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.464 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.0 ttmp? -57.82 -42.82 85.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.942 0.401 . . . . 0.0 110.552 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 77.0 m -72.06 -48.56 43.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.747 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.1 64.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.8 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.02 -55.25 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.65 7.13 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.451 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 54.92 20.31 18.83 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.533 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.538 ' N ' ' HA ' ' A' ' 110' ' ' HIS . . . -55.5 -65.94 3.19 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.844 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.538 ' HA ' ' N ' ' A' ' 109' ' ' GLY . 29.7 t-80 -93.08 -40.41 10.53 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 117.695 0.747 . . . . 0.0 111.315 0.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -157.28 146.98 20.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.077 0.465 . . . . 0.0 111.502 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.468 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 85.6 m -76.25 147.18 38.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.906 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.33 131.12 35.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.756 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.0 mt -115.26 140.9 48.71 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.22 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -61.45 130.04 44.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.008 0.432 . . . . 0.0 110.341 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.35 -13.06 58.54 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.13 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.51 141.28 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.042 0.449 . . . . 0.0 111.359 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.67 128.29 34.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.097 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 41.5 pt -113.39 159.53 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.579 0.704 . . . . 0.0 112.818 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.5 tp -116.09 110.5 18.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.889 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 56.0 mt -97.98 118.01 33.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.469 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.561 ' NH2' HG21 ' A' ' 68' ' ' VAL . 54.4 ttp85 -103.0 116.39 32.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.73 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.529 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.3 t-80 -59.29 105.67 0.36 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 177.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 46.9 t -50.28 -45.56 54.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.529 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.5 t80 -64.2 -61.85 1.99 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.427 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -76.62 -13.75 60.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 72.82 1.34 54.49 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.172 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 53.9 mtt -84.04 -164.98 1.02 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 68.9 m-85 -135.42 138.67 43.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.75 126.2 23.11 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 42.1 t -134.69 148.27 50.28 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.6 t -95.21 96.57 9.28 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.525 -1.216 . . . . 0.0 107.758 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.5 mt -73.96 152.03 40.2 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 89.9 p -83.66 6.41 20.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.083 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.3 p -95.4 121.6 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.724 0.297 . . . . 0.0 111.025 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.407 ' H ' ' HA ' ' A' ' 140' ' ' THR . 47.4 t -62.82 -57.06 12.19 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.772 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -166.24 -33.55 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.643 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.4 t -157.23 111.28 2.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.935 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.5 t 58.13 23.13 9.82 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.011 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.407 ' HA ' ' H ' ' A' ' 136' ' ' SER . 73.8 m 65.85 136.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.309 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -137.84 -86.58 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.868 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.608 ' HG2' ' H ' ' A' ' 143' ' ' LEU . 35.5 tttm -178.23 -170.3 0.22 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.751 0.31 . . . . 0.0 110.814 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.608 ' H ' ' HG2' ' A' ' 142' ' ' LYS . 4.3 mm? 60.09 -108.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.804 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.96 145.74 25.87 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.401 0.62 . . . . 0.0 112.321 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.53 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.2 m-85 -101.73 170.54 8.1 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.887 -1.051 . . . . 0.0 108.98 178.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.35 142.47 27.7 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 67.7 t -112.71 117.22 54.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.344 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.06 -146.89 5.54 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.844 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 73.1 mt -117.92 152.61 35.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.838 0.352 . . . . 0.0 110.531 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -142.32 140.1 32.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.66 -46.37 46.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.463 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -87.17 143.3 27.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 72.2 p -105.83 -8.54 17.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -53.23 114.44 1.47 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.513 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.91 -155.39 20.19 Favored Glycine 0 N--CA 1.441 -1.028 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.614 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -123.04 -13.94 7.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.704 0.288 . . . . 0.0 111.362 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.53 -32.99 67.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 74.3 m -90.47 8.14 35.33 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -111.55 132.26 54.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.055 0.455 . . . . 0.0 111.486 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.9 m95 -126.75 118.41 24.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.661 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -80.08 126.59 31.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.98 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.444 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -88.19 135.8 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -128.77 150.72 75.72 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.253 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.679 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.16 138.87 53.33 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.585 2.19 . . . . 0.0 112.349 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.19 -40.29 45.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.557 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 96.0 p -109.05 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.6 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.76 5.05 53.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.655 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -85.48 -29.56 24.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.041 0.448 . . . . 0.0 110.866 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.679 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 73.9 mmt-85 -92.11 146.71 23.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.374 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 45.1 t -129.52 167.55 17.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.322 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.24 136.19 56.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.376 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.48 -15.91 55.15 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.459 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 170' ' ' SER . 30.8 mt-10 -68.36 155.48 39.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.026 0.441 . . . . 0.0 111.254 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -73.38 141.47 47.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.43 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 162' ' ' ILE . 98.1 t -91.07 123.1 43.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.375 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.4 HH11 ' N ' ' A' ' 12' ' ' GLN . 28.9 mmt180 -87.69 154.67 20.4 Favored 'General case' 0 CA--C 1.496 -1.126 0 CA-C-O 121.266 0.555 . . . . 0.0 111.405 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.76 120.95 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.62 -11.63 30.3 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.907 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -72.21 126.73 30.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.75 0.309 . . . . 0.0 110.779 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.562 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.4 m-20 -69.49 115.5 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 73.9 mt -100.31 148.26 24.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.763 0.792 . . . . 0.0 112.961 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.445 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.6 mt -113.49 112.75 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 176.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.4 mp -93.16 139.45 30.58 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.073 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 191' ' ' TYR . 71.4 t -130.8 127.8 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.718 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 4.3 m -65.05 124.95 23.44 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 94.2 t -69.1 -32.07 52.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.716 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.88 -36.2 36.9 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 61.3 m -116.64 4.9 13.17 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -177.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.15 31.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.467 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 30.0 mtt85 -112.25 141.69 45.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.2 m-85 -72.88 152.92 41.24 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.418 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 30.5 tp -75.11 76.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.442 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -76.88 150.12 36.04 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.1 tp -99.87 119.09 37.66 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.627 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 55.6 p -113.48 147.7 37.36 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -107.0 90.8 3.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.555 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.2 -174.49 45.7 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.411 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 18.0 m120 0.6 -78.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.397 0.679 . . . . 0.0 112.449 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 57.4 m -147.68 12.85 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.126 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 54.6 m -126.9 -178.14 4.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.56 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.9 m95 -107.88 134.44 50.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.175 0.512 . . . . 0.0 111.158 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.555 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 17.1 m80 -126.46 172.46 10.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.1 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.93 131.59 70.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.237 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -148.73 172.09 15.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.655 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.25 95.54 7.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.022 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.9 -179.03 3.52 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.299 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -88.61 7.94 30.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.442 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.17 138.33 51.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.584 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.445 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.4 mt-30 -68.37 173.41 4.9 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.274 1.035 . . . . 0.0 112.828 -178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -164.79 120.4 1.43 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 113.121 -1.854 . . . . 0.0 107.843 178.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.5 mt -73.89 127.52 33.06 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.47 -0.492 . . . . 0.0 109.943 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.418 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.76 140.92 48.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.731 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.2 t -107.9 100.45 9.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.55 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 65.0 t -92.16 102.93 14.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.781 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.27 142.09 28.13 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.349 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.426 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.2 Cg_exo -63.54 103.99 0.42 Allowed 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.218 1.946 . . . . 0.0 111.165 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.512 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.0 mm . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.295 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 120.728 0.299 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.452 ' HB3' HG23 ' A' ' 112' ' ' THR . 68.6 m-85 -116.67 154.58 30.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.332 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.1 mt -76.91 120.61 22.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.7 mmm180 -109.87 156.19 20.71 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.066 0.46 . . . . 0.0 111.217 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.0 p -67.1 157.68 33.01 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 70.53 -4.71 1.57 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.426 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.6 m-20 -72.28 133.01 44.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.75 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -79.53 119.84 23.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.54 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.1 m -137.06 172.41 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.68 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 5.4 m -132.71 137.55 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.368 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.773 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -97.8 120.66 38.59 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.854 -0.339 . . . . 0.0 110.535 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 39.2 mt-30 -119.0 159.68 23.41 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.416 0.627 . . . . 0.0 111.521 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.9 p -146.24 140.76 26.78 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.563 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -83.35 124.09 30.29 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.405 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.18 118.5 32.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.914 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.9 m -122.4 136.56 54.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.736 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 tt -176.0 143.84 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.781 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.3 m80 58.03 42.51 22.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.391 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 60.03 22.02 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.426 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -127.19 129.67 48.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.704 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -121.72 144.45 48.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.022 0.439 . . . . 0.0 111.18 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -155.37 175.58 13.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.806 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 23.9 mtmm -122.36 136.63 54.93 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.561 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -126.51 141.28 51.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.64 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.593 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.7 t -105.08 144.8 31.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.976 0.417 . . . . 0.0 110.633 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 130' ' ' LEU . 34.7 tp -64.01 115.34 4.82 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.817 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.432 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.0 163.83 14.62 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.56 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.04 166.83 10.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.753 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.3 144.46 32.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.439 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.63 14.94 38.76 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.288 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -117.64 146.76 43.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.8 0.333 . . . . 0.0 110.693 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -135.24 14.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.538 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -84.3 9.33 13.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.629 0.252 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.59 30.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.177 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.68 139.54 38.49 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.093 0.473 . . . . 0.0 110.712 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.5 m -80.67 152.62 28.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -146.96 -163.91 1.87 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.436 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.28 140.71 49.84 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 112.203 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -107.89 137.92 45.04 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.673 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.471 ' HA ' HD23 ' A' ' 35' ' ' LEU . 49.3 m -78.31 142.62 37.62 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.517 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 71.6 p -105.55 157.67 17.22 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.362 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.491 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 20.8 t -51.29 -17.69 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.323 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 61.78 25.96 15.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.402 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.5 m -146.22 68.85 1.19 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.355 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -82.5 -19.45 38.71 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.043 0.537 . . . . 0.0 110.453 -0.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.517 ' C ' ' HB ' ' A' ' 52' ' ' THR . 0.8 OUTLIER -158.14 -103.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.213 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.4 t 60.79 100.49 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.43 ' HG3' HG22 ' A' ' 52' ' ' THR . 6.7 Cg_exo -75.12 139.34 23.87 Favored 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 123.17 2.58 . . . . 0.0 111.211 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.41 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.1 Cg_endo -50.43 -36.95 50.21 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.364 2.042 . . . . 0.0 111.641 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -122.52 82.78 2.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.682 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 21' ' ' VAL . 42.0 tp -64.62 -30.76 71.79 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.1 p -48.83 -52.65 23.02 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.432 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 31.0 pt -69.94 -15.14 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.68 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.95 -1.87 38.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.2 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.458 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.7 m -84.17 134.01 34.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 0.0 112.199 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -138.2 161.38 37.0 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.952 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.555 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.5 t -125.82 132.12 71.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.727 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.83 64.5 5.63 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.2 mm-40 -43.3 -62.83 0.94 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -178.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.434 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.6 mm-40 -124.74 164.33 20.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.744 0.783 . . . . 0.0 112.716 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.3 t -156.29 84.08 0.99 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.387 -1.279 . . . . 0.0 108.888 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.403 HD13 ' SD ' ' A' ' 81' ' ' MET . 3.8 mt -112.99 154.94 25.67 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.397 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 81.9 p -67.68 150.21 49.01 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.462 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 43.2 t -52.69 -41.94 39.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.055 0.455 . . . . 0.0 110.274 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.9 ttp85 -59.98 -51.44 69.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.13 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.65 91.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.745 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.5 tp -64.18 -44.17 92.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.862 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 53.2 mt-30 -67.92 -35.42 78.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.964 0.411 . . . . 0.0 110.469 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.54 -42.33 92.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.704 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.448 ' O ' HG23 ' A' ' 85' ' ' THR . 66.7 mtt -64.7 -44.1 91.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.79 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.42 -35.21 80.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.098 0.475 . . . . 0.0 110.374 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -35.4 77.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.98 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -77.68 -17.66 57.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.556 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.448 HG23 ' O ' ' A' ' 81' ' ' MET . 42.1 p -89.19 5.58 44.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.877 0.37 . . . . 0.0 111.252 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.2 t -83.84 -31.38 8.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.333 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -87.97 -28.2 21.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.955 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -132.55 139.26 47.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 77.8 p -118.95 16.41 13.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.084 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -123.1 141.04 52.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.995 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.03 37.36 0.76 Allowed Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.782 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -98.78 -71.08 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.673 0.273 . . . . 0.0 111.261 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 17.4 m -57.5 151.9 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.623 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.54 81.51 8.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.539 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.456 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.9 p -81.29 0.71 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.688 -179.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.795 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.1 OUTLIER -53.96 -38.77 65.33 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.795 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.5 mttt -88.18 -52.02 5.46 Favored 'General case' 0 C--N 1.352 0.684 0 CA-C-N 120.431 1.469 . . . . 0.0 111.529 -3.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -65.85 -28.76 69.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.033 -1.44 . . . . 0.0 113.071 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 75.7 mmtt -59.51 -48.96 79.62 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.139 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.643 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 74.3 t80 -73.96 -39.53 63.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.564 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.5 ttm -59.87 -38.09 81.2 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.573 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.17 -46.93 30.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.675 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -58.01 -43.83 86.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 62.9 m -72.07 -45.72 59.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.49 -56.56 18.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.288 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -70.66 -35.33 72.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.265 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.68 -66.04 3.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.695 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.68 -84.94 0.17 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.665 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.544 ' HA2' ' HB3' ' A' ' 110' ' ' HIS . . . 152.87 -179.73 29.08 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.544 ' HB3' ' HA2' ' A' ' 109' ' ' GLY . 4.1 t60 56.37 42.38 27.76 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.953 1.377 . . . . 0.0 111.697 -0.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -125.55 140.22 52.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.198 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.452 HG23 ' HB3' ' A' ' 13' ' ' PHE . 88.8 m -71.28 146.36 48.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.348 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.39 133.31 35.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.419 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.56 142.31 47.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.994 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -63.25 124.45 21.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.132 0.491 . . . . 0.0 110.484 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.94 -13.64 41.21 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.887 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.48 141.31 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.993 0.425 . . . . 0.0 111.328 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.25 128.45 34.2 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.3 pt -113.01 159.36 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.579 0.704 . . . . 0.0 112.833 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.434 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.42 109.29 17.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.834 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -97.5 116.86 30.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.696 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.555 ' NH2' HG21 ' A' ' 68' ' ' VAL . 61.8 ttp85 -102.67 116.51 32.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.706 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 19.5 t-80 -59.88 106.78 0.53 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.458 ' OG ' HG22 ' A' ' 66' ' ' THR . 41.5 m -52.06 -43.45 63.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -176.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.47 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 56.4 t80 -66.0 -58.67 5.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.0 m -79.12 -13.3 59.82 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLY . . . . . 0.447 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 72.18 -0.85 37.13 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.307 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.2 mtt -83.24 -165.47 1.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -133.94 139.0 45.84 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 37' ' ' LEU . 23.5 tp -55.77 124.95 19.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.1 t -133.36 148.08 51.84 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -176.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -94.19 98.76 11.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.1 mt -76.91 147.34 37.06 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.578 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -78.89 6.22 9.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.911 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.9 p -92.2 124.1 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t -62.85 -60.6 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.879 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.1 tpt180 -176.76 -61.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.0 p -142.4 23.99 1.95 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.573 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.3 m 59.12 88.88 0.06 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.79 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.1 t -170.14 -24.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.143 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -143.63 -179.09 6.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.677 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -139.79 16.07 2.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.339 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.75 -73.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.938 0.399 . . . . 0.0 110.32 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -115.12 154.59 28.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.008 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.7 m-85 -99.87 171.09 8.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.272 178.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -90.17 143.59 26.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.031 0.443 . . . . 0.0 109.935 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.21 116.0 51.38 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.311 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.64 -151.75 6.61 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.91 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 46.3 mt -113.51 149.14 34.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -140.38 140.06 35.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.69 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -74.17 -49.4 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.551 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.01 143.85 30.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.834 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.5 p -106.47 -7.81 17.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.707 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.3 p -52.88 114.96 1.6 Allowed 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.636 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.75 -157.04 19.67 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.712 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.503 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -120.16 -13.9 8.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.759 0.314 . . . . 0.0 111.338 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 68.4 m -90.63 8.05 36.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -110.84 132.58 54.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.042 0.449 . . . . 0.0 111.241 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.453 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.4 m95 -127.03 116.23 20.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.721 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.3 p -78.3 125.18 28.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.476 HD12 HG21 ' A' ' 175' ' ' VAL . 3.7 pt -86.92 136.66 22.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.844 0.354 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 75.3 m-70 -128.58 149.04 70.76 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.095 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.645 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 33.9 Cg_endo -65.31 137.07 49.93 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.455 2.103 . . . . 0.0 112.511 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.408 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -78.22 -40.1 38.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.426 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 78.4 p -105.95 -171.21 1.86 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.406 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -95.03 -7.25 40.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.408 ' NE2' ' N ' ' A' ' 168' ' ' GLN . 1.7 mp0 -72.99 -32.39 65.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.022 0.439 . . . . 0.0 110.883 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.645 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.2 mmp_? -90.25 146.66 24.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.499 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.2 m -130.15 167.22 18.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.126 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -66.77 128.79 37.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.337 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 96.11 -13.55 65.76 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -70.55 156.39 39.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.045 0.45 . . . . 0.0 111.283 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.409 ' HD3' ' CZ ' ' A' ' 13' ' ' PHE . 34.9 mttp -73.91 139.67 45.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.456 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.476 HG21 HD12 ' A' ' 162' ' ' ILE . 93.1 t -89.7 119.53 36.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.213 179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.422 ' HD3' ' CD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -83.8 153.71 23.93 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 121.246 0.546 . . . . 0.0 111.516 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 13.6 t -68.6 118.31 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.67 -8.01 29.97 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.276 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.14 136.34 44.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.79 0.329 . . . . 0.0 110.802 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 38.6 m-20 -76.98 114.2 15.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.414 HD21 HG13 ' A' ' 175' ' ' VAL . 64.4 mt -99.64 149.25 23.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.755 0.788 . . . . 0.0 112.955 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.511 HD13 ' NE2' ' A' ' 209' ' ' GLN . 66.3 mt -114.62 112.17 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 176.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -91.8 139.44 30.67 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.089 0.471 . . . . 0.0 112.156 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.46 HG22 ' CD1' ' A' ' 191' ' ' TYR . 72.7 t -131.88 121.74 47.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.902 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 95.6 p -61.42 120.27 10.15 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.503 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 91.7 t -63.38 -34.03 64.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.319 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.6 p -77.73 -39.33 44.84 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.7 m -113.71 7.39 17.18 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.39 31.29 1.24 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.461 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 22.1 mtt180 -112.7 140.65 47.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.96 0.409 . . . . 0.0 110.812 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 50.8 m-85 -72.91 152.97 41.2 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.428 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 37.4 tp -74.92 77.56 2.16 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 175.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -77.5 150.61 34.84 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -174.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.0 tp -100.43 117.81 35.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.589 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 43.0 t -111.32 145.7 38.36 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.45 90.17 3.33 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.587 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.37 -175.55 45.49 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.432 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' A' ' 197' ' ' GLY . 9.9 m120 1.16 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.449 0.7 . . . . 0.0 112.459 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 77.3 p -146.13 10.62 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.153 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 67.3 p -125.23 -177.88 4.02 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.992 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.6 m95 -108.23 137.3 46.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 111.206 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.587 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 16.6 m80 -129.22 172.47 11.42 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.027 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.54 134.7 65.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.246 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -153.06 170.93 19.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.509 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.06 94.47 6.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.82 178.18 4.38 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.402 -177.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -86.41 10.97 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -119.5 136.83 54.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.511 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.3 mt-30 -65.07 176.3 1.31 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 122.399 1.095 . . . . 0.0 113.143 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.5 m -169.28 120.43 0.72 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 112.946 -1.933 . . . . 0.0 107.729 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 22.4 mt -74.6 127.58 33.44 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.041 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.428 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.7 m95 -114.34 141.82 47.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.733 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.3 t -108.87 100.44 9.65 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.524 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.773 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.8 t -91.82 102.13 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.682 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.87 141.96 27.65 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.233 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.403 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.76 104.46 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.033 1.822 . . . . 0.0 111.316 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.54 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.202 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -118.82 153.31 34.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.811 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 34.4 mt -79.58 122.32 26.35 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.8 mmm180 -110.17 157.3 19.54 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.018 0.437 . . . . 0.0 111.272 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.6 p -67.79 155.22 39.82 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.889 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.66 -7.89 1.49 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.624 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 69' ' ' LEU . 5.1 m-20 -69.15 137.94 53.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.767 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -84.39 119.38 25.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.0 m -136.15 170.03 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.699 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.4 m -132.14 139.65 49.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.414 176.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.799 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -100.58 119.72 38.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.7 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 39.5 mt-30 -117.6 163.34 16.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 121.298 0.57 . . . . 0.0 111.374 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.25 144.24 25.46 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.2 m -87.41 123.29 32.2 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.621 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.576 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.04 121.18 42.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.885 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.5 m -124.73 132.91 53.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.714 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.3 tt -172.0 148.88 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.644 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.3 m80 58.75 41.44 21.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.43 21.93 11.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.39 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -126.34 150.12 48.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.534 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -135.38 146.47 48.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.91 0.386 . . . . 0.0 110.839 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.455 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.7 pt20 -158.37 172.01 19.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.763 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -118.7 137.09 53.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.534 178.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.511 HD23 ' HA ' ' A' ' 51' ' ' SER . 2.2 mt -127.37 140.75 51.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.746 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 53.6 t -104.47 146.97 28.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.926 0.393 . . . . 0.0 110.259 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.9 tp -66.57 112.23 4.03 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.799 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.48 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.32 163.72 13.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.436 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.433 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -167.01 162.72 15.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.912 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.71 144.02 45.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.68 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.55 18.81 31.76 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.167 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -124.33 146.57 48.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.841 0.353 . . . . 0.0 110.607 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.15 -137.65 18.78 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.434 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -80.89 7.76 9.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.655 0.264 . . . . 0.0 110.922 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.18 32.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.046 179.669 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.1 mt -78.72 135.43 37.15 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.982 0.42 . . . . 0.0 110.693 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -75.57 150.35 38.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.569 0.699 . . . . 0.0 111.33 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -144.39 -165.84 2.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.502 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 37' ' ' LEU . 35.0 mt -129.99 143.6 50.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.395 0.617 . . . . 0.0 112.238 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -111.93 137.37 50.02 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.674 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.511 ' HA ' HD23 ' A' ' 35' ' ' LEU . 84.6 p -76.12 145.06 40.26 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.674 HG22 ' HG3' ' A' ' 59' ' ' PRO . 76.0 p -107.96 174.25 5.96 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.399 -0.521 . . . . 0.0 111.756 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.608 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 47.3 t 18.4 58.95 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 114.242 -1.345 . . . . 0.0 112.733 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -96.92 -20.98 17.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.625 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.553 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 77.2 p -169.46 66.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.408 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HA ' ' N ' ' A' ' 55' ' ' SER . 23.6 pttm -149.56 37.81 0.75 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 122.882 0.473 . . . . 0.0 111.305 0.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.425 ' N ' ' HA ' ' A' ' 53' ' ' SER . 51.4 t30 -167.44 125.23 1.24 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.388 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.608 ' H ' ' HB2' ' A' ' 53' ' ' SER . 0.5 OUTLIER 61.55 167.22 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.52 178.47 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.674 ' HG3' HG22 ' A' ' 52' ' ' THR . 22.7 Cg_exo -58.67 139.39 90.51 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.162 1.908 . . . . 0.0 111.643 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.12 -38.76 94.37 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.172 1.915 . . . . 0.0 111.228 179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -123.76 90.39 3.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.668 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.633 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp -68.91 -28.93 67.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.386 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.9 m -48.43 -49.64 34.38 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.48 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.7 pt -72.67 -16.92 18.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.856 -179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.699 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -99.09 -1.07 40.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.409 -178.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 ' OG ' ' A' ' 124' ' ' SER . 31.3 m -86.18 132.2 34.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 112.187 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -136.41 161.51 35.62 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.043 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.575 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.41 133.66 68.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.751 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 121' ' ' LEU . 17.9 mt -82.34 65.59 7.55 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.4 mm-40 -44.42 -63.91 0.79 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 56.1 mm-40 -123.78 164.74 18.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.69 0.757 . . . . 0.0 112.742 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.21 86.98 1.03 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.068 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.477 HD13 ' SD ' ' A' ' 81' ' ' MET . 4.2 mt -113.73 156.08 24.44 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.138 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.8 t -69.19 149.35 48.69 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 49.6 t -51.34 -44.4 31.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.074 0.464 . . . . 0.0 110.361 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.4 ttp-105 -56.99 -57.04 14.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.985 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -58.14 -43.17 87.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.633 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.36 -48.02 83.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.076 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 54.0 mt-30 -64.32 -36.2 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.007 0.432 . . . . 0.0 110.584 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.9 -42.08 95.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.033 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.477 ' SD ' HD13 ' A' ' 73' ' ' LEU . 67.9 mtt -65.43 -43.15 91.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.992 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.44 -31.81 71.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.972 0.415 . . . . 0.0 110.528 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.74 -33.33 70.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.666 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -78.05 -16.33 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.532 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 81' ' ' MET . 43.5 p -89.11 -2.05 58.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.797 0.332 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.33 -22.56 19.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.316 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -61.27 -74.1 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -136.79 -61.85 0.66 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 81.1 p -159.6 -175.41 5.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.757 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.608 ' HG2' ' H ' ' A' ' 92' ' ' GLN . 0.2 OUTLIER -103.04 -33.05 9.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.042 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.6 33.48 85.09 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.535 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.608 ' H ' ' HG2' ' A' ' 90' ' ' GLU . 44.4 mt-30 -112.5 7.86 19.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.807 0.337 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.0 m -64.92 179.94 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.369 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.472 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 6.4 m-20 -71.82 88.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.471 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.88 -10.34 11.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.766 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.768 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 25.1 mm-40 -53.08 -44.89 67.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.723 -179.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.712 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 16.6 ptpt -86.66 -49.63 7.37 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.21 1.404 . . . . 0.0 111.304 -3.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -54.19 -41.48 68.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.854 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 66.1 tttp -59.56 -31.07 69.08 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.95 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.768 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.1 t80 -73.3 -44.94 58.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.43 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 68.1 mmm -56.79 -46.96 81.21 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.07 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 57.2 ttp -68.84 -42.82 76.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.336 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -57.68 -45.8 85.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.849 0.356 . . . . 0.0 110.856 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.468 HG23 ' HA3' ' A' ' 108' ' ' GLY . 36.5 m -68.54 -43.54 76.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.846 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.59 72.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.859 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -69.77 -54.29 14.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -163.04 70.48 0.21 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.751 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.468 ' HA3' HG23 ' A' ' 104' ' ' THR . . . -71.68 5.83 10.52 Favored Glycine 0 CA--C 1.518 0.261 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.493 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.91 -151.94 0.88 Allowed Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.449 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -134.75 150.87 50.62 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.019 0.909 . . . . 0.0 110.679 -0.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -166.15 142.71 5.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.095 0.474 . . . . 0.0 111.315 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 80.9 m -74.25 147.18 42.65 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.53 130.48 35.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -114.95 141.66 47.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.159 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.94 125.4 23.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 105.17 -12.28 48.49 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.121 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.41 142.29 32.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.081 0.467 . . . . 0.0 111.237 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.92 126.41 32.45 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.5 pt -112.19 159.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.449 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 19.1 tp -114.38 109.24 18.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.877 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.441 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.11 116.22 28.92 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.779 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.575 ' NH2' HG21 ' A' ' 68' ' ' VAL . 58.7 ttp85 -101.86 116.5 32.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.715 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.4 t-80 -59.8 106.22 0.46 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.465 ' OG ' HG22 ' A' ' 66' ' ' THR . 62.0 m -49.18 -46.5 45.6 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 63.3 t80 -64.06 -64.26 0.94 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.401 ' HG ' ' CE1' ' A' ' 123' ' ' HIS . 14.7 m -72.69 -14.79 61.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.1 -1.45 40.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.179 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 49.3 mtt -82.01 -165.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.525 0.203 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 66.6 m-85 -134.6 138.69 44.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.484 HD13 HD21 ' A' ' 37' ' ' LEU . 25.1 tp -54.99 126.14 23.34 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.4 t -134.71 147.77 50.15 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.0 t -95.48 98.12 10.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.0 mt -75.02 149.54 39.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -80.84 5.96 14.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.783 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.8 p -90.32 122.83 33.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.737 0.303 . . . . 0.0 111.074 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.423 ' HB3' ' HB2' ' A' ' 141' ' ' ASP . 48.9 m -64.63 -60.59 2.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.8 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -176.62 -60.2 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.672 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.7 p -159.56 -46.16 0.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.527 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.7 p -101.05 -161.64 0.88 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.591 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 38.2 p -57.26 -72.65 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.372 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.423 ' HB2' ' HB3' ' A' ' 136' ' ' SER . 18.0 m-20 59.28 -83.86 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 74.68 -20.88 0.31 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.55 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 141' ' ' ASP . 4.6 mm? -60.24 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.772 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -102.17 149.0 24.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.54 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -100.83 170.79 8.08 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.166 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -89.43 143.76 26.57 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 120.995 0.426 . . . . 0.0 109.949 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.4 t -113.49 118.0 56.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.312 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.48 -148.43 5.51 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.98 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.455 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 52.2 mt -115.92 151.29 35.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.077 0.465 . . . . 0.0 110.831 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -141.15 139.94 34.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.579 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -73.35 -52.87 12.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -82.57 147.05 28.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 58.2 p -105.49 -5.03 20.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -55.74 113.08 1.33 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.453 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.47 -159.61 21.45 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.593 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 36.5 mt-10 -118.79 -13.26 9.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.808 0.337 . . . . 0.0 111.428 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.94 -32.88 66.44 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 64.9 m -91.17 7.19 41.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.19 133.98 52.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.016 0.436 . . . . 0.0 111.253 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.44 ' O ' HG12 ' A' ' 119' ' ' ILE . 57.3 m95 -128.8 117.72 21.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.822 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.433 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 13.6 p -79.08 125.65 29.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.112 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.01 136.11 23.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.94 0.4 . . . . 0.0 110.943 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.6 m-70 -128.76 151.41 77.15 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.305 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.704 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.1 Cg_endo -67.51 140.93 53.81 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.598 2.199 . . . . 0.0 112.274 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -44.52 53.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.847 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -110.8 -170.85 1.72 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.248 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.534 ' HE3' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -92.44 9.26 35.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.149 -179.819 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.534 HE22 ' HE3' ' A' ' 167' ' ' LYS . 9.9 mm-40 -83.03 -35.25 25.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.548 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.704 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 77.3 mmt-85 -91.96 146.56 23.64 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.299 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 46.1 t -123.95 165.52 17.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.398 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.18 129.46 40.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.23 -13.53 64.54 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.851 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.49 156.09 39.83 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.401 ' HG2' HG21 ' A' ' 112' ' ' THR . 37.6 mttp -72.81 140.51 47.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.473 HG21 HD12 ' A' ' 162' ' ' ILE . 93.4 t -90.25 120.06 38.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.534 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -83.85 155.64 22.83 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 121.344 0.593 . . . . 0.0 111.533 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.429 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.0 t -71.13 120.33 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.08 -11.69 31.67 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.167 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -70.67 129.82 40.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.742 0.306 . . . . 0.0 110.907 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.578 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.5 m-20 -71.41 114.81 9.87 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.409 HD21 HG13 ' A' ' 175' ' ' VAL . 69.2 mt -100.43 148.11 25.11 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.507 HD13 ' NE2' ' A' ' 209' ' ' GLN . 50.7 mt -113.64 113.39 43.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -93.12 137.1 32.77 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.167 0.508 . . . . 0.0 112.107 -178.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.436 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.7 t -129.14 121.1 53.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 86.5 p -61.31 124.19 19.9 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.6 t -67.81 -32.25 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.172 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 98.2 p -77.52 -37.75 50.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.5 m -116.58 6.94 13.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.55 31.39 1.33 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.4 mtt85 -111.8 143.69 42.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.827 0.346 . . . . 0.0 110.862 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.5 m-85 -74.87 154.01 38.41 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -76.14 76.05 2.98 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.6 t60 -76.54 149.64 36.65 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -174.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.2 tp -98.75 119.09 36.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.966 -1.47 . . . . 0.0 107.614 176.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 44.5 t -113.07 146.74 38.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -105.46 92.67 4.29 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.696 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -76.03 -170.31 29.62 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.0 p30 -11.22 -67.57 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.439 0.695 . . . . 0.0 112.812 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 56.9 m -153.22 12.41 0.48 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 0.0 109.89 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 51.7 m -128.4 -179.8 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.576 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.8 m95 -106.5 135.31 48.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 111.245 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.696 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 13.7 m80 -127.53 173.54 9.78 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.916 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -129.06 128.49 67.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.236 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -144.94 172.09 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.746 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.99 95.98 7.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.39 -179.98 3.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.323 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -88.3 10.21 20.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.903 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 75.0 mt-30 -117.87 137.13 52.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.575 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.507 ' NE2' HD13 ' A' ' 182' ' ' ILE . 95.8 mt-30 -67.27 175.7 2.57 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.341 1.067 . . . . 0.0 113.039 -178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.5 m -168.76 121.65 0.82 Allowed 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.065 -1.88 . . . . 0.0 107.748 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.6 mt -74.33 130.55 39.9 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.837 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.437 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.2 m95 -118.44 125.32 49.69 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 121.416 0.627 . . . . 0.0 111.343 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.6 m -91.08 101.11 13.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.157 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.799 HG22 ' HG ' ' A' ' 22' ' ' LEU . 98.1 t -93.57 103.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.765 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.82 142.24 28.05 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.218 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.447 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.5 Cg_exo -63.6 104.23 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.218 1.946 . . . . 0.0 111.265 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.296 -0.859 . . . . 0.0 111.167 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.762 0.315 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -119.21 154.41 33.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.801 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.28 123.18 27.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -109.49 157.08 19.34 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.016 0.436 . . . . 0.0 111.296 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 6.1 p -67.79 156.08 37.84 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.66 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.15 -9.18 1.18 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.771 -179.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.5 m-20 -67.88 132.61 47.68 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -79.47 122.28 26.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.1 m -138.26 171.44 15.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.567 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -132.71 136.49 55.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.163 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.76 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.9 mp -97.16 123.87 41.06 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.556 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.697 HE22 ' HB2' ' A' ' 57' ' ' ASN . 35.0 mt-30 -124.78 145.99 49.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.714 0.769 . . . . 0.0 112.326 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.3 p -132.88 143.64 49.65 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.711 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -86.88 120.23 27.94 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.992 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.609 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -109.81 119.2 38.62 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.372 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.3 m -123.66 141.73 51.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.345 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' ND1' ' A' ' 29' ' ' HIS . 21.2 tt -170.65 140.03 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.86 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.473 ' ND1' HG12 ' A' ' 28' ' ' ILE . 3.6 p-80 38.46 58.4 1.62 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.517 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 6.5 mmmm 58.27 35.61 25.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.965 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -139.0 113.78 9.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -117.95 148.07 42.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.461 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -163.01 173.54 13.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.549 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE2' ' NE2' ' A' ' 23' ' ' GLN . 39.1 mtpt -118.56 136.84 53.63 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.668 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.57 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.98 142.08 51.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.324 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.7 p -105.66 142.12 35.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.072 0.463 . . . . 0.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -63.71 112.9 3.06 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.047 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.469 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.49 164.07 13.72 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.581 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.9 165.0 14.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.597 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -139.44 146.4 40.04 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.656 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.15 10.84 59.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -121.29 153.58 37.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.743 0.306 . . . . 0.0 110.658 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.7 -135.89 15.07 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.318 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -87.13 8.21 24.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.658 0.266 . . . . 0.0 110.87 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.14 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.651 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 55.6 mt -80.32 140.44 36.14 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.773 0.32 . . . . 0.0 110.544 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.629 ' SG ' HG13 ' A' ' 203' ' ' VAL . 29.6 p -81.05 150.9 28.64 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 111.112 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -144.4 -166.47 2.39 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.838 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 48.3 mt -130.47 144.93 51.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.335 0.588 . . . . 0.0 112.208 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.9 mt-10 -110.48 135.33 51.32 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.604 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.57 ' HA ' HD23 ' A' ' 35' ' ' LEU . 53.2 m -79.09 132.54 36.63 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.51 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 53.7 p -100.91 170.29 8.4 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.623 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -70.39 -5.98 32.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.427 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 59.91 13.42 3.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.01 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 78.0 p -147.12 80.42 1.52 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 54.4 mtpt -86.22 -28.6 23.76 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 122.937 0.495 . . . . 0.0 110.918 -0.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.697 ' HB2' HE22 ' A' ' 23' ' ' GLN . 2.1 p-10 -176.07 31.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.034 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.46 107.98 1.55 Allowed Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 2.9 Cg_exo -78.48 140.97 17.44 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.905 2.403 . . . . 0.0 111.161 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -48.94 -40.52 40.3 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.477 2.118 . . . . 0.0 111.405 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.407 ' O ' HG12 ' A' ' 64' ' ' ILE . 11.8 t70 -128.27 92.99 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.619 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 HG11 ' A' ' 21' ' ' VAL . 48.5 tp -69.8 -30.66 68.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.945 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.6 m -51.83 -46.78 64.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.268 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.469 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.3 pt -70.68 -18.72 21.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 32.5 m -99.9 12.33 37.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.716 0.293 . . . . 0.0 111.073 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -90.14 129.35 36.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 111.841 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -136.17 161.22 36.33 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.148 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.572 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.27 132.21 71.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.612 178.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.8 mt -80.84 65.81 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.507 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 13.2 mm-40 -44.67 -66.9 0.33 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.483 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 53.5 mm-40 -121.25 164.24 17.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.611 0.719 . . . . 0.0 112.895 -177.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -154.76 86.55 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.285 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 mt -113.91 154.47 27.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.387 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.2 t -68.58 146.25 53.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.0 t -45.86 -49.08 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.187 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -52.6 -53.84 41.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.926 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' O ' ' SD ' ' A' ' 81' ' ' MET . . . -57.77 -53.48 57.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.297 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.0 tp -51.49 -45.41 62.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.237 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -65.58 -34.8 79.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.947 0.403 . . . . 0.0 110.284 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.61 -39.05 84.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.715 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.454 ' SD ' ' O ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.33 -47.75 82.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.631 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.16 -34.41 74.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.119 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.23 -31.3 71.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.11 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -73.03 -17.99 61.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 69.8 p -92.98 -3.05 55.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.802 0.334 . . . . 0.0 111.368 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.4 t -75.54 -54.89 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -72.52 96.52 1.95 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.245 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 54.96 -166.04 0.1 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.0 m -95.41 5.43 51.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.942 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -102.39 172.22 7.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.041 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.91 7.77 8.44 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.629 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -94.65 138.17 32.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.797 0.332 . . . . 0.0 110.992 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 13.9 t -77.7 -8.93 12.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.462 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 6.3 m-20 -74.69 81.82 2.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.639 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.94 -4.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.884 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.803 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.7 mm-40 -53.95 -42.69 69.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.76 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.763 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 95.3 mttt -86.03 -50.43 7.05 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 120.13 1.332 . . . . 0.0 111.409 -2.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -54.45 -44.14 72.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.057 -177.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 98.8 mttt -56.07 -34.94 66.43 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.356 -179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.803 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -73.84 -42.48 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.705 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 56.1 tpp -57.33 -41.25 79.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.543 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 54.2 ttp -73.12 -43.03 62.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.554 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.9 ttmp? -58.05 -42.59 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.055 0.455 . . . . 0.0 110.307 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.0 m -72.58 -40.43 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.9 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.86 -39.19 84.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.091 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -80.43 -35.68 34.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.587 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.33 -17.61 80.15 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.2 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -71.49 -41.7 57.43 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.426 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -113.15 165.15 12.01 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.469 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -78.4 154.37 30.75 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 117.453 0.626 . . . . 0.0 110.868 0.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 15.0 ptm180 -139.34 140.56 37.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.138 0.494 . . . . 0.0 111.332 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.4 m -72.65 147.45 45.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.196 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.55 129.58 34.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.695 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -113.03 143.6 44.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.374 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.503 ' HD2' ' HG2' ' A' ' 173' ' ' GLU . 38.0 m-85 -62.66 143.9 56.86 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.115 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 86.07 -14.99 51.41 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.557 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.496 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.5 OUTLIER -79.81 141.98 35.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.138 0.494 . . . . 0.0 111.611 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.54 127.18 33.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.226 177.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.9 pt -112.0 162.62 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.575 0.702 . . . . 0.0 112.855 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.483 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.2 tp -117.36 109.95 17.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.96 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.1 mt -98.02 116.25 29.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.767 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.572 ' NH2' HG21 ' A' ' 68' ' ' VAL . 57.9 ttp85 -102.83 116.8 33.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.787 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.9 t-80 -59.39 107.1 0.52 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.6 t -48.66 -50.26 33.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.457 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.5 t80 -61.49 -66.67 0.5 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.422 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.9 p -67.41 -21.36 65.59 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.4 -2.01 68.69 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.157 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -83.06 -165.61 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.465 0.174 . . . . 0.0 110.659 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.3 m-85 -134.03 139.66 46.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.6 tp -55.55 125.31 20.45 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.7 t -133.84 148.23 51.28 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 50.5 t -95.07 98.13 10.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.513 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.67 155.75 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.263 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.8 t -86.43 6.61 29.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.943 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.8 p -92.32 124.21 36.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.655 0.264 . . . . 0.0 111.081 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.1 t -61.51 -58.57 7.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 0.0 110.806 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -152.9 -65.64 0.16 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 80.0 p -132.86 -24.63 1.91 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.95 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.9 p -137.31 -172.49 3.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.3 p -75.73 110.93 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.189 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.4 156.58 40.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.773 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -79.05 -157.3 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.806 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.48 ' HB3' ' H ' ' A' ' 144' ' ' ALA . 4.3 mm? 60.35 -162.9 0.25 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.189 0.519 . . . . 0.0 111.505 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -40.84 144.98 0.22 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.503 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.4 m-85 -104.79 176.07 5.28 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.433 177.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.41 141.75 28.22 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.593 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 59.9 t -111.21 125.87 68.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -141.41 -151.58 5.58 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.562 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 76.8 mt -115.77 143.94 44.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.042 0.448 . . . . 0.0 110.841 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -133.69 141.07 47.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.932 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.14 -64.02 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.54 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.89 149.1 36.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.716 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.1 p -103.46 1.32 32.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.948 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.2 p -55.69 114.46 1.88 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.73 -161.29 18.13 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.606 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.0 mt-10 -118.2 -11.38 10.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.75 0.31 . . . . 0.0 111.146 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.83 66.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.04 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.4 m -90.21 7.66 37.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.722 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -111.17 132.03 54.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.399 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.476 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.9 m95 -127.28 116.42 20.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.676 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 12.8 p -78.85 125.24 29.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.152 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.03 137.07 21.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.818 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 86.7 m-70 -130.8 149.21 73.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.264 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.615 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 23.7 Cg_endo -64.36 137.76 57.27 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.323 2.015 . . . . 0.0 112.244 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.1 49.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.742 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 68.6 m -113.15 -167.61 1.21 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 167' ' ' LYS . 8.1 tmtm? -91.41 1.48 57.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.78 -26.53 34.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.615 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 14.6 mmp_? -94.14 145.67 24.53 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.478 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 173' ' ' GLU . 69.4 m -111.63 152.63 27.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.047 -178.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.523 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.1 OUTLIER -71.72 132.11 44.07 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 79.77 -4.53 64.87 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.541 ' HB3' ' O ' ' A' ' 170' ' ' SER . 0.0 OUTLIER -79.16 154.8 29.02 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.66 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 173' ' ' GLU . 81.5 mttt -59.05 138.32 57.59 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.225 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 90.1 t -93.75 116.93 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.104 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.432 ' HB2' ' OD2' ' A' ' 179' ' ' ASP . 11.1 mpt_? -80.03 154.01 28.45 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.177 0.513 . . . . 0.0 111.519 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 42.2 t -68.73 122.53 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 176.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.75 -13.5 35.13 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.23 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 169' ' ' ARG . 71.1 m-20 -68.36 129.1 38.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.79 0.329 . . . . 0.0 110.719 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -71.86 112.81 8.28 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.442 HD21 HG13 ' A' ' 175' ' ' VAL . 65.2 mt -97.29 150.66 20.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.834 0.826 . . . . 0.0 113.158 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.538 HD13 ' NE2' ' A' ' 209' ' ' GLN . 43.9 mt -115.21 113.97 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 176.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.99 135.01 35.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.001 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.456 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.0 t -127.55 122.06 58.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.933 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 29.5 t -62.23 122.03 14.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -67.08 -30.86 50.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.025 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.49 -40.0 36.64 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.9 m -115.13 7.78 15.47 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.56 31.63 1.4 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 190' ' ' ARG . 4.9 mtt-85 -113.13 142.26 45.96 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -73.54 153.33 40.32 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.5 tp -75.12 76.33 2.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 175.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.496 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.2 t60 -76.32 151.29 36.73 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.93 115.19 29.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 113.604 -1.634 . . . . 0.0 107.731 177.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 67.7 m -107.86 147.46 30.91 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -106.72 92.26 4.03 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.666 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.47 -173.46 39.75 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.341 -0.933 . . . . 0.0 111.594 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' A' ' 197' ' ' GLY . 10.5 p-10 -5.55 -71.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 199' ' ' SER . . . . . 0.415 ' H ' ' CG ' ' A' ' 198' ' ' ASN . 54.3 m -151.97 13.83 0.61 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 31.2 t -127.86 -179.33 4.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.742 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.609 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.3 m95 -108.08 134.99 50.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.223 0.535 . . . . 0.0 111.321 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.666 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 13.4 m80 -127.51 177.96 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.942 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 203' ' ' VAL . . . . . 0.629 HG13 ' SG ' ' A' ' 47' ' ' CYS . 3.0 p -132.36 130.2 60.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.47 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 54.7 p-10 -146.56 173.97 11.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.632 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.06 91.76 4.93 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -110.43 -179.51 3.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -87.73 5.03 41.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.484 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.496 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 65.8 mt-30 -112.99 137.95 50.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.635 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.538 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.2 mt-30 -64.86 175.23 1.56 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 122.35 1.072 . . . . 0.0 112.852 -178.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.8 m -168.17 119.96 0.83 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 112.997 -1.911 . . . . 0.0 107.846 178.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 25.1 mt -74.56 129.34 37.56 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.436 -0.505 . . . . 0.0 109.996 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 99.0 m95 -116.42 145.43 43.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.521 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -112.47 99.86 8.31 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.345 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.76 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.5 t -91.46 99.98 10.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.573 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.63 140.47 23.92 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.3 Cg_exo -62.36 103.97 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.097 1.865 . . . . 0.0 111.141 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.568 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.6 mm . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.295 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.466 ' HG2' ' HB ' ' A' ' 177' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.867 0.365 . . . . 0.0 111.037 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -114.42 160.92 18.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.215 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.8 mt -82.85 118.74 23.64 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.6 mmm180 -107.36 158.13 17.4 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.242 0.544 . . . . 0.0 111.342 -179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.511 ' OG1' ' HB3' ' A' ' 110' ' ' HIS . 3.9 p -68.41 154.44 41.81 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 72.46 -2.91 2.47 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.786 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.436 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.1 m-20 -73.82 138.44 44.45 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.741 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -84.34 121.18 27.17 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.554 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.7 m -137.5 169.73 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.7 137.04 56.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 114.678 -1.147 . . . . 0.0 108.277 176.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.745 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.3 mp -97.8 123.91 41.96 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.614 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' OE1' ' HB3' ' A' ' 57' ' ' ASN . 23.4 mt-30 -124.56 146.75 48.85 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.544 0.688 . . . . 0.0 112.194 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.23 143.67 49.28 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.746 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 m -86.56 120.48 27.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.213 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.62 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.74 121.09 44.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.179 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.8 m -125.75 133.13 52.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.004 0.43 . . . . 0.0 111.775 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.476 HG23 ' CD2' ' A' ' 29' ' ' HIS . 16.9 tt -169.85 146.56 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.382 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.476 ' CD2' HG23 ' A' ' 28' ' ' ILE . 37.1 m-70 57.68 43.7 21.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.02 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.8 OUTLIER 58.91 23.57 11.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.364 179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.03 144.12 50.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.371 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -132.0 147.6 52.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.917 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -161.35 171.13 18.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 21.6 mtpp -118.85 139.12 52.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.381 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.9 144.24 51.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.303 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.6 p -108.37 139.83 42.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 0.0 110.693 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.1 tp -62.13 113.23 2.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.1 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.37 168.3 9.97 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.597 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -172.74 165.34 5.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.66 150.97 48.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.511 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.26 -0.35 88.58 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.816 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -113.96 153.87 28.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.868 0.366 . . . . 0.0 111.056 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.38 -128.24 8.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.523 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.0 t-20 -91.31 3.87 53.78 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.749 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 43.12 28.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.584 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 mt -81.31 133.87 35.5 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.418 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.7 m -72.63 150.2 43.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -145.94 -170.39 3.47 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.503 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.489 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.1 mt -129.17 143.28 50.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.497 0.665 . . . . 0.0 112.45 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.4 mt-10 -107.68 138.44 43.9 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.765 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.549 ' HA ' HD23 ' A' ' 35' ' ' LEU . 53.0 m -81.99 133.13 35.28 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 176.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.532 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 49.3 p -103.29 165.13 11.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.686 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 88.5 p -72.49 -7.86 52.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.181 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 57' ' ' ASN . 29.5 m-80 60.74 12.59 3.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.974 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 71.0 p -156.2 79.47 0.97 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 50.7 mtpt -107.13 91.22 3.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.15 0.58 . . . . 0.0 110.929 -0.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.532 ' C ' ' HB ' ' A' ' 52' ' ' THR . 27.0 m-20 56.32 20.59 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.06 108.63 1.99 Allowed Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.54 139.6 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.907 2.405 . . . . 0.0 111.157 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -49.08 -39.1 41.25 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.358 2.039 . . . . 0.0 111.542 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -128.42 89.71 2.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.674 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp -66.95 -29.24 69.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.168 -178.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.0 m -52.28 -50.22 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 29.8 pt -68.6 -17.34 22.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 51.4 m -100.27 11.4 39.47 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.826 0.346 . . . . 0.0 111.03 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -90.22 130.11 36.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.11 0.481 . . . . 0.0 111.689 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -136.45 160.83 37.58 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.102 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.3 t -124.83 132.57 71.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.863 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.436 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.6 mt -80.9 64.33 5.62 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.523 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.6 mm-40 -43.5 -64.02 0.73 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.465 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 58.4 mm-40 -123.18 162.93 21.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.707 0.765 . . . . 0.0 112.888 -177.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.6 m -154.13 84.9 1.14 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.987 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 mt -113.18 154.19 27.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.187 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.54 ' HB3' HH12 ' A' ' 76' ' ' ARG . 47.4 t -67.76 149.1 50.37 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 48.5 t -49.94 -43.86 20.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.88 0.371 . . . . 0.0 110.276 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.54 HH12 ' HB3' ' A' ' 74' ' ' SER . 1.9 tmm_? -58.7 -52.94 63.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.22 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.421 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -59.51 -44.11 93.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.702 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.9 tp -62.24 -48.06 81.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.345 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.74 -32.27 73.72 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.816 0.341 . . . . 0.0 110.543 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.2 -41.2 86.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.654 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.5 mtt -64.11 -45.33 89.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.912 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' HG23 ' A' ' 86' ' ' VAL . 64.0 mt -68.27 -35.47 77.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.37 75.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -67.32 -29.79 69.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.352 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.9 p -76.12 -16.18 59.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.277 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 82' ' ' LEU . 23.5 t -84.52 -27.87 6.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.092 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.534 ' HG3' ' HG2' ' A' ' 88' ' ' LYS . 14.1 tp10 -85.46 -79.07 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.534 ' HG2' ' HG3' ' A' ' 87' ' ' GLU . 7.6 ptpp? -170.08 -176.79 2.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.011 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t 63.27 159.49 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.434 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -169.09 172.73 7.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.748 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 110.38 28.29 4.12 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.638 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 60.16 -179.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.884 0.374 . . . . 0.0 111.054 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 m -87.77 146.99 5.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.003 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.636 ' HA ' ' HD3' ' A' ' 97' ' ' LYS . 16.8 m-20 -121.73 77.54 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.888 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.3 t -71.02 -59.37 3.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.689 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.8 mm-40 -73.31 -51.77 16.31 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.027 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.652 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 25.1 tptp -87.75 -38.2 15.98 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 124.5 1.12 . . . . 0.0 109.942 -4.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -53.62 -44.64 69.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.697 -178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -61.69 -27.7 68.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.211 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.689 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 66.4 t80 -74.25 -49.44 23.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.501 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 58.6 ttp -60.66 -38.84 86.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.846 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.1 mtp -72.13 -45.4 60.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.014 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -59.15 -41.07 87.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.837 0.351 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 55.2 p -71.91 -43.81 64.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.91 -29.59 70.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.33 -56.43 4.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.797 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.37 -28.57 67.38 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.77 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 113.81 -115.5 3.61 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.433 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.483 ' HA2' ' HA ' ' A' ' 110' ' ' HIS . . . -171.55 146.08 9.23 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.546 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.511 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 37.6 t-80 -152.09 -59.19 0.15 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.915 0.858 . . . . 0.0 110.83 -0.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -162.91 145.89 10.76 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-O 121.373 0.606 . . . . 0.0 112.16 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.4 m -81.49 150.55 28.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.838 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.42 130.44 35.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.734 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.5 mt -115.49 143.25 45.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.142 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -63.97 129.68 41.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.039 0.447 . . . . 0.0 110.49 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.43 -11.71 58.25 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.944 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.01 141.09 31.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.091 0.472 . . . . 0.0 111.388 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.02 127.18 33.33 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 160' ' ' TRP . 40.5 pt -110.99 163.52 7.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.541 0.686 . . . . 0.0 112.602 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.465 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.5 tp -118.81 108.46 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.752 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.417 ' CD2' HD23 ' A' ' 69' ' ' LEU . 57.7 mt -96.75 117.47 31.11 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.739 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.523 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 18.9 ttp180 -104.02 116.69 32.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.553 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.45 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.8 t-80 -59.82 106.68 0.51 Allowed 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.7 t -49.83 -45.31 50.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 31.8 t80 -67.01 -59.88 3.11 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.9 m -74.72 -14.74 60.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.26 -2.84 26.05 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.376 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' MET . . . . . 0.428 ' HB2' ' HB3' ' A' ' 149' ' ' LEU . 50.1 mtt -82.95 -165.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.4 m-85 -132.94 138.9 47.07 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.2 tp -54.78 126.03 22.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.579 ' SG ' HD21 ' A' ' 133' ' ' LEU . 16.7 p -136.34 148.66 48.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.3 t -94.82 97.4 10.01 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.726 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.579 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.0 mt -72.89 154.86 40.4 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.458 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -83.0 2.31 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.186 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.5 p -95.74 120.97 36.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.78 0.324 . . . . 0.0 111.107 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 78.0 p -67.05 -52.17 45.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.551 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -174.74 -28.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.0 p -163.37 65.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.653 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 56.2 m 64.25 154.93 0.06 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.282 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 53.4 m 65.7 129.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.481 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.85 130.62 47.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.706 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -142.96 94.14 2.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.493 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.409 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 4.4 mm? 56.27 -84.62 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.321 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -101.93 154.27 19.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.482 0.658 . . . . 0.0 112.085 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.2 m-85 -100.54 170.24 8.51 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.113 177.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -89.38 145.1 25.57 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.7 t -113.89 117.14 54.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.529 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.23 -151.54 6.45 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.987 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.9 mt -115.71 141.72 47.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.423 . . . . 0.0 110.731 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.498 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -130.92 140.72 50.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.695 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.86 -69.01 0.37 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.585 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.96 148.41 46.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.685 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.0 p -104.21 0.16 29.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.127 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -55.54 112.77 1.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.436 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.17 -160.22 20.57 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.672 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.482 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 32.0 mt-10 -118.95 -10.73 9.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.98 -33.13 66.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 82.5 m -91.84 9.69 31.74 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.18 132.5 54.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 0.0 111.353 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.463 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -128.44 116.66 20.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.728 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 15.5 p -78.6 126.73 31.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.252 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.496 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.93 136.77 22.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.879 0.371 . . . . 0.0 110.887 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -130.77 150.3 76.06 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.315 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.719 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 39.5 Cg_endo -66.49 141.01 59.52 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.664 2.242 . . . . 0.0 112.295 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.52 -46.31 48.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.78 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 21.3 t -113.61 -177.23 3.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.126 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.494 ' HD2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -85.31 15.23 4.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.281 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.494 HE22 ' HD2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -85.89 -36.25 20.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.196 0.522 . . . . 0.0 110.2 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.719 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.8 mmp_? -93.89 148.23 22.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.061 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 49.1 m -125.12 166.71 15.93 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.234 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.47 133.44 50.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.186 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 90.83 -12.07 69.95 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.302 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.8 mt-10 -72.42 154.6 40.8 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 120.999 0.428 . . . . 0.0 111.183 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -70.42 142.44 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.496 HG21 HD12 ' A' ' 162' ' ' ILE . 85.8 t -92.48 111.88 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.588 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 155.29 38.09 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 121.435 0.636 . . . . 0.0 111.49 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.466 ' HB ' ' HG2' ' A' ' 12' ' ' GLN . 41.5 t -71.37 120.41 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.2 -12.37 33.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.261 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.778 0.323 . . . . 0.0 110.859 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.502 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.1 m-20 -69.93 110.65 5.14 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.487 HD21 HG13 ' A' ' 175' ' ' VAL . 70.2 mt -97.28 148.89 22.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.783 0.801 . . . . 0.0 113.088 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 209' ' ' GLN . 52.6 mt -114.16 113.18 43.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.5 mp -93.34 137.51 32.58 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.0 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.5 t -129.19 126.85 64.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.61 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.2 t -66.09 127.72 33.25 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 99.5 t -71.22 -32.12 46.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.979 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -80.13 -35.69 36.34 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.5 m -116.94 4.79 12.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.42 31.8 1.39 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.409 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 26.1 mtt180 -113.58 141.05 47.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.019 0.437 . . . . 0.0 110.759 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 48.5 m-85 -71.5 153.71 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.41 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.23 75.61 2.36 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.08 150.36 38.88 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -174.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.3 tp -100.28 116.53 32.47 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 113.667 -1.606 . . . . 0.0 107.632 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.416 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 47.5 t -110.16 146.79 34.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -105.26 94.56 5.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.7 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.86 -169.51 33.81 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.961 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.9 p30 -11.54 -66.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.425 0.69 . . . . 0.0 112.714 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 53.1 m -154.62 11.92 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.193 0.52 . . . . 0.0 109.731 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 69.4 m -127.04 -178.69 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.851 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.62 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.64 135.69 48.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.167 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.7 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 10.9 m80 -128.32 172.99 10.55 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.004 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.9 p -127.2 134.32 66.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.297 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.9 p30 -151.7 172.03 16.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.594 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.86 93.84 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.209 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.04 174.09 6.07 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.191 -177.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -83.08 9.35 10.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.01 135.54 54.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.678 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.51 ' NE2' HD13 ' A' ' 182' ' ' ILE . 92.4 mt-30 -65.61 175.56 1.8 Allowed 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.284 1.04 . . . . 0.0 113.028 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.9 m -168.73 122.32 0.85 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.144 -1.844 . . . . 0.0 107.936 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 55.1 mt -76.42 127.43 32.83 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.082 0.468 . . . . 0.0 109.969 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.4 m95 -114.81 146.98 40.43 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.682 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.9 t -114.15 100.8 8.65 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.163 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.745 HG22 ' HG ' ' A' ' 22' ' ' LEU . 78.4 t -92.6 102.02 13.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.74 141.04 25.43 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.113 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.418 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.86 103.41 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.129 1.886 . . . . 0.0 111.266 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.554 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.489 ' HG2' ' HB ' ' A' ' 177' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.879 0.371 . . . . 0.0 110.978 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -115.52 157.47 24.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.388 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 22.2 mt -80.18 122.63 27.07 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 11.2 mmm180 -111.63 157.84 19.95 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.059 0.457 . . . . 0.0 111.215 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.409 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 11.6 p -68.36 155.32 40.04 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.868 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.94 -8.37 1.29 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.639 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.7 m-20 -69.07 135.03 50.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 12.7 tt0 -80.24 119.03 22.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.53 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.1 m -135.08 171.9 16.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.676 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.05 140.89 45.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.658 -1.156 . . . . 0.0 108.473 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.765 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -101.52 121.1 41.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.689 0.281 . . . . 0.0 110.5 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.503 ' NE2' HG21 ' A' ' 52' ' ' THR . 76.1 mt-30 -121.58 152.59 39.08 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.536 0.684 . . . . 0.0 111.791 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' HD22 ' A' ' 194' ' ' LEU . 24.3 t -139.05 143.99 38.61 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.741 179.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.3 m -86.33 121.28 28.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.39 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.589 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.16 119.92 39.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.001 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.6 m -124.86 137.04 54.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.944 0.402 . . . . 0.0 111.582 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.7 tt -173.08 143.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.54 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.8 m80 58.91 37.41 24.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.877 0.37 . . . . 0.0 110.713 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.88 25.63 15.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.105 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -127.07 122.59 34.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.468 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -114.98 145.18 42.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.332 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.447 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.8 pt20 -157.63 171.15 20.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.563 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -118.56 134.83 54.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.59 178.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.559 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.6 mt -124.47 142.47 51.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.341 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 54.0 t -107.09 141.3 38.54 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.644 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 tp -61.01 113.22 2.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.992 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.458 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.15 164.74 12.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.271 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.35 162.32 10.32 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.694 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -133.18 146.7 51.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.831 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.89 3.34 85.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.788 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -114.08 152.18 31.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 110.972 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.02 -140.45 23.13 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.725 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.0 4.69 11.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.621 0.248 . . . . 0.0 111.147 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.25 31.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.158 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.3 mt -77.67 139.72 39.48 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.466 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.0 m -79.58 149.7 31.3 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.564 0.697 . . . . 0.0 111.284 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -145.18 -166.21 2.37 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.555 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.6 mt -130.47 145.21 51.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.438 0.637 . . . . 0.0 112.301 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -111.17 135.19 52.05 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.769 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.559 ' HA ' HD23 ' A' ' 35' ' ' LEU . 80.1 p -77.58 138.13 38.97 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.62 ' O ' ' N ' ' A' ' 54' ' ' ASN . 69.8 p -103.42 129.92 50.64 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.109 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.48 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 p -10.91 63.79 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 52' ' ' THR . 24.0 t-20 66.97 -9.45 0.36 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.669 ' HA ' ' C ' ' A' ' 56' ' ' LYS . 88.3 p 54.58 101.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.808 0.443 . . . . 0.0 112.009 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.669 ' C ' ' HA ' ' A' ' 55' ' ' SER . 0.1 OUTLIER 55.6 -142.2 0.8 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.921 1.288 . . . . 0.0 111.844 -0.077 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.45 ' C ' ' HB ' ' A' ' 52' ' ' THR . 8.8 p30 -178.12 -19.97 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.898 0.38 . . . . 0.0 110.875 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 21.8 t -63.67 108.91 2.07 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 58' ' ' VAL . 3.9 Cg_exo -78.0 139.95 17.67 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 176.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -51.77 -38.93 68.01 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.331 2.02 . . . . 0.0 111.531 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -126.52 91.07 3.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.74 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.596 HD11 HG11 ' A' ' 21' ' ' VAL . 47.3 tp -69.33 -31.14 69.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.662 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -49.6 -48.14 49.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.458 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.6 pt -72.67 -17.88 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 111.467 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.676 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.69 -0.67 45.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.118 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.486 HG22 ' OG ' ' A' ' 124' ' ' SER . 28.3 m -86.2 132.77 33.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.208 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -137.4 163.08 31.92 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.889 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.544 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.6 t -126.14 133.6 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.719 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.47 HD11 HG11 ' A' ' 20' ' ' VAL . 15.9 mt -82.58 64.35 7.18 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.1 mm-40 -43.7 -61.32 1.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -178.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 60.9 mm-40 -125.36 164.53 20.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 112.893 -177.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -156.64 85.08 0.97 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.893 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.417 HD13 ' SD ' ' A' ' 81' ' ' MET . 3.1 mt -114.9 155.44 26.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.279 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.3 p -68.6 148.52 50.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.2 t -50.03 -44.16 21.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.161 0.505 . . . . 0.0 110.235 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.0 ttp85 -57.91 -51.2 70.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.236 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.84 -43.06 99.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.706 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.83 -47.11 87.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.988 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -65.33 -35.26 80.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.97 -43.22 93.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.653 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.417 ' SD ' HD13 ' A' ' 73' ' ' LEU . 67.5 mtt -62.41 -44.52 96.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.85 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.65 -31.81 70.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.99 -31.77 68.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.724 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -67.97 -22.32 65.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.168 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 45.4 p -84.74 -13.54 50.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.167 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.27 -43.29 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.022 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -150.72 105.61 3.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.639 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -74.58 157.02 36.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.986 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 52.6 m -124.97 -63.19 1.18 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.792 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -89.16 -71.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.31 34.25 3.7 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.81 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -152.58 132.16 13.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.847 0.356 . . . . 0.0 110.794 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.3 t -96.55 -66.43 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.316 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 97' ' ' LYS . 5.0 m-20 -71.84 89.59 1.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.77 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.404 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.0 t -87.16 -9.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.868 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.814 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 8.2 mm-40 -53.96 -40.58 66.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.882 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 18.9 pttp -86.53 -50.53 6.78 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 120.349 1.431 . . . . 0.0 111.611 -2.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.484 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.6 t-105 -56.55 -39.24 73.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.293 -1.321 . . . . 0.0 113.135 -177.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 51.6 tttp -61.39 -33.75 74.19 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.287 -179.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.814 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 24.5 t80 -73.93 -44.8 53.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.899 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 17.6 tpt -59.37 -39.17 82.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.65 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 53.1 ttp -71.0 -47.37 59.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.849 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -59.06 -45.01 91.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.1 m -66.98 -46.96 73.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.108 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.88 72.15 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.189 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -64.67 -36.43 84.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.753 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.92 -76.76 0.62 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.452 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 53.86 -123.12 25.65 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.577 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -127.08 -172.27 13.23 Favored Glycine 0 CA--C 1.52 0.393 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.256 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.427 ' CD2' ' H ' ' A' ' 110' ' ' HIS . 7.6 p80 -83.99 -167.69 1.84 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 117.648 0.724 . . . . 0.0 111.215 0.013 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.409 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 15.6 ptm180 -148.11 152.39 37.24 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.161 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 91.2 m -79.33 145.34 33.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.33 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.54 132.25 35.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.802 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -116.31 142.46 46.81 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.202 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -62.56 129.82 42.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.083 0.468 . . . . 0.0 110.473 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.56 -12.21 58.14 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.56 140.42 32.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.971 0.415 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.98 128.31 33.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.0 pt -112.42 158.62 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 112.747 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.1 tp -114.44 108.98 17.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.88 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.0 mt -97.35 115.6 28.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.691 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.544 ' NH2' HG21 ' A' ' 68' ' ' VAL . 64.9 ttp85 -102.22 116.42 32.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.712 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.471 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.6 t-80 -58.09 108.69 0.63 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.486 ' OG ' HG22 ' A' ' 66' ' ' THR . 67.6 m -50.3 -53.3 29.58 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.471 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.8 t80 -56.82 -69.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -63.96 -31.96 73.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 89.24 -0.54 81.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.959 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.9 mtt -83.73 -165.82 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.432 -0.21 . . . . 0.0 110.432 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.49 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.3 m-85 -133.66 138.38 45.86 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 24.8 tp -54.07 125.96 20.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 47.6 t -135.13 149.93 50.1 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 40.8 t -96.69 97.12 9.1 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.7 mt -74.0 155.93 38.08 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.483 -178.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.3 m -84.93 2.37 43.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.856 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 48.0 p -89.16 124.55 34.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.692 0.282 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.6 p -66.08 -60.54 2.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.4 -78.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.468 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 72.8 m -161.58 8.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.718 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.412 ' HB3' ' OD2' ' A' ' 141' ' ' ASP . 11.5 t -123.94 -169.16 1.91 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.891 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 10.2 m -88.81 -9.38 51.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.451 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.412 ' OD2' ' HB3' ' A' ' 139' ' ' SER . 3.3 p30 -51.18 153.01 2.13 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.885 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -130.71 10.9 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.589 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.66 -83.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -98.19 152.14 19.69 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 121.414 0.626 . . . . 0.0 111.997 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.3 m-85 -101.9 174.28 6.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.93 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -93.65 142.55 27.22 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.54 118.68 58.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.97 5.91 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.713 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 54.3 mt -115.07 146.73 41.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.074 0.464 . . . . 0.0 110.67 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -138.72 139.72 38.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.848 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.81 -78.56 0.07 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.692 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.21 146.91 46.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.645 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 120' ' ' LEU . 74.1 p -105.13 5.42 32.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.267 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.9 p -58.35 111.69 1.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.668 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.53 -163.35 19.53 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.937 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.481 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 30.8 mt-10 -116.35 -8.81 11.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.774 0.321 . . . . 0.0 111.261 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.84 -32.13 67.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.5 p -93.41 10.27 32.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.11 131.71 54.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.1 0.476 . . . . 0.0 111.479 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.438 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.6 m95 -126.63 116.76 21.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.912 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.9 p -78.62 127.09 31.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.167 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.467 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.86 135.02 26.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.947 0.403 . . . . 0.0 110.953 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.429 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 66.6 m-70 -127.26 149.88 70.9 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.217 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.636 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.41 138.07 49.23 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.522 2.148 . . . . 0.0 112.216 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.21 -40.3 52.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.565 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.2 p -108.63 -171.75 1.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.489 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -91.78 -8.0 47.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.203 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -71.42 -34.25 70.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.211 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 71.3 mmt-85 -89.99 146.3 24.47 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.708 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 40.8 t -129.19 168.18 16.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.976 0.417 . . . . 0.0 111.383 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.7 136.16 55.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.96 -17.3 51.85 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.293 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 170' ' ' SER . 24.1 mt-10 -67.3 155.99 37.52 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.919 0.39 . . . . 0.0 111.396 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.4 mttt -71.84 144.17 49.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.477 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.467 HG21 HD12 ' A' ' 162' ' ' ILE . 92.8 t -94.89 112.81 28.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.316 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -77.7 155.17 31.46 Favored 'General case' 0 CA--C 1.5 -0.964 0 CA-C-O 121.392 0.615 . . . . 0.0 111.471 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.489 ' HB ' ' HG2' ' A' ' 12' ' ' GLN . 53.0 t -69.2 121.82 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.72 -17.15 33.33 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.291 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -63.27 127.02 29.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.738 0.304 . . . . 0.0 110.824 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.6 m-20 -69.88 112.89 6.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -98.19 149.01 23.01 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.517 HD13 ' NE2' ' A' ' 209' ' ' GLN . 48.6 mt -113.56 113.23 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.5 136.17 33.44 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.257 0.551 . . . . 0.0 112.354 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.442 HG22 ' CD1' ' A' ' 191' ' ' TYR . 70.8 t -129.03 125.25 62.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.545 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 45.4 t -64.5 126.55 28.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.77 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.481 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -69.77 -33.93 58.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.991 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.36 -36.32 39.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 56.3 m -116.3 5.45 13.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.07 31.26 1.53 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 31.4 mtt85 -112.04 142.67 44.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.899 0.38 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.9 m-85 -74.29 153.56 39.31 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -75.86 76.82 2.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 175.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.405 ' HA ' ' OG1' ' A' ' 210' ' ' THR . 82.0 t60 -76.44 149.32 36.86 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 -174.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.569 HD22 ' SG ' ' A' ' 24' ' ' CYS . 11.4 tp -100.33 114.64 28.3 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.634 177.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.406 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 41.6 t -107.17 147.33 30.23 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -106.45 91.39 3.68 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.668 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -76.14 -174.19 37.13 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.496 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 80.3 m-20 -5.6 -75.87 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.243 0.617 . . . . 0.0 112.457 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 35.8 t -146.32 14.4 1.27 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.097 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 59.3 m -128.33 -179.83 5.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.996 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.589 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.4 m95 -107.89 135.48 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.23 0.538 . . . . 0.0 111.243 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.668 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 11.5 m80 -128.2 174.92 8.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.881 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.7 p -129.29 133.16 66.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.35 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.77 173.07 14.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.669 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.37 96.24 7.58 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.71 -179.5 3.67 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -88.44 10.72 19.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.424 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -118.99 134.88 54.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.058 0.456 . . . . 0.0 110.72 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.517 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.8 mt-30 -61.31 175.09 0.6 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.364 1.078 . . . . 0.0 112.844 -178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 210' ' ' THR . . . . . 0.41 HG23 ' SG ' ' A' ' 24' ' ' CYS . 22.8 m -168.65 119.35 0.76 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 112.979 -1.918 . . . . 0.0 107.782 178.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.7 mt -74.19 128.89 36.71 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.024 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.4 m95 -116.12 146.31 42.34 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.466 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -113.78 100.55 8.54 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.304 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.765 HG22 ' HG ' ' A' ' 22' ' ' LEU . 95.6 t -92.88 100.55 11.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.19 141.8 26.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.074 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.413 ' HD3' HG13 ' A' ' 177' ' ' VAL . 26.8 Cg_exo -62.42 103.88 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.192 1.928 . . . . 0.0 111.265 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.53 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.311 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -120.2 150.36 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.43 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.92 129.58 38.18 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.3 mmt85 -117.4 157.38 26.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.098 0.475 . . . . 0.0 111.103 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 9.1 p -67.95 155.08 40.25 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.726 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.07 -7.8 1.43 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.699 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.9 m-20 -69.33 133.05 47.37 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.836 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.32 121.16 25.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.495 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 22.1 m -136.07 173.0 14.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.61 HG11 HD11 ' A' ' 62' ' ' LEU . 3.1 m -134.93 136.74 51.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.169 176.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -98.06 124.86 42.77 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.655 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 22.9 mt-30 -124.91 145.01 50.03 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 121.664 0.745 . . . . 0.0 112.295 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.7 p -131.42 146.11 52.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.882 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -88.16 123.49 32.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.627 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.37 120.03 38.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.304 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.8 m -125.17 136.51 53.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.934 0.397 . . . . 0.0 111.685 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.0 tt -173.8 143.64 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.564 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 49.0 m80 61.15 32.63 19.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.734 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mmmm 67.74 22.31 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.075 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -126.06 124.61 41.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.511 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -116.16 147.28 41.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.208 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -158.21 172.98 17.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 23.1 mtmm -120.4 136.02 54.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.1 mt -125.3 145.28 50.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.391 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 28.9 p -107.42 140.09 40.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.08 0.467 . . . . 0.0 110.622 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -62.75 111.62 2.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.072 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.69 166.05 11.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.461 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.2 163.09 15.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.31 149.94 46.14 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.66 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.1 -5.25 89.32 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.755 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -107.39 157.35 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 0.0 110.938 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -141.57 23.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.368 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -83.34 9.54 10.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.683 0.278 . . . . 0.0 110.705 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.28 29.78 0.25 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.124 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -80.01 139.41 36.99 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.819 0.342 . . . . 0.0 110.512 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 31.5 p -78.71 148.15 33.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.364 0.602 . . . . 0.0 111.031 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -141.25 -165.57 1.99 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.001 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 29.7 mt -131.97 146.22 51.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.293 0.568 . . . . 0.0 112.374 -178.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 3.8 mt-10 -111.6 134.57 53.09 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.718 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.598 ' HA ' HD23 ' A' ' 35' ' ' LEU . 81.4 p -77.75 130.39 36.68 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.57 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 70.5 p -103.09 170.4 7.99 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.3 m -72.8 11.48 0.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.44 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 52' ' ' THR . 25.0 t-20 66.31 -78.93 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.453 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 46.8 t -129.67 98.92 4.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.81 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.511 ' HB3' HG23 ' A' ' 58' ' ' VAL . 62.2 tttm -72.33 163.11 28.52 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.127 0.571 . . . . 0.0 110.842 0.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.57 ' C ' ' HB ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -81.44 42.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.67 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.511 HG23 ' HB3' ' A' ' 56' ' ' LYS . 61.9 t -64.21 111.72 6.09 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 58' ' ' VAL . 3.0 Cg_exo -78.74 140.17 16.28 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.831 2.354 . . . . 0.0 110.906 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -48.65 -38.99 37.67 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.338 2.025 . . . . 0.0 111.619 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -134.02 97.19 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.562 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.61 HD11 HG11 ' A' ' 21' ' ' VAL . 49.2 tp -71.75 -30.39 65.54 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.141 -178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.4 m -50.94 -44.31 60.37 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 38' ' ' ALA . 23.3 pt -73.07 -20.67 18.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 56.4 m -97.54 12.75 32.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.948 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.6 m -91.31 128.29 37.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.145 0.498 . . . . 0.0 111.729 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -136.09 161.53 35.45 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.129 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.589 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -125.46 132.43 71.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.5 mt -80.71 66.56 6.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 16.3 mm-40 -45.68 -64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.439 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 57.5 mm-40 -122.12 163.08 20.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.705 0.764 . . . . 0.0 112.826 -177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.3 m -154.69 85.9 1.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.427 -1.26 . . . . 0.0 108.771 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.9 158.09 20.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.538 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.9 p -70.49 146.49 50.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 50.7 t -48.63 -44.25 14.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.099 0.476 . . . . 0.0 110.539 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -57.98 -53.11 61.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.3 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -43.3 96.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.769 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.4 tp -62.03 -47.54 84.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.306 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 51.9 mt-30 -64.36 -35.99 82.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.728 0.299 . . . . 0.0 110.741 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -65.08 -43.38 92.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.868 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.8 mtt -61.95 -43.42 98.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.693 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 86' ' ' VAL . 81.7 mt -69.86 -32.97 71.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.845 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.91 -31.42 69.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.788 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -76.29 -18.06 59.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.537 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 70.8 p -88.65 -7.51 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.845 0.355 . . . . 0.0 111.182 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 82' ' ' LEU . 23.5 t -79.84 -31.78 13.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.717 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -94.36 -60.33 1.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.748 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -113.06 128.26 56.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.917 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.0 m -61.96 -73.01 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.944 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -132.13 -80.2 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.988 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.29 20.01 68.97 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.461 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -117.73 150.83 38.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.857 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -136.56 137.0 48.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.958 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.544 ' HB3' ' HG2' ' A' ' 96' ' ' GLU . 5.8 m-20 -73.96 93.78 2.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.078 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.63 2.52 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 121.246 0.546 . . . . 0.0 110.84 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.695 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.5 OUTLIER -52.41 -50.14 63.1 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.715 -179.298 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.695 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 84.9 mttt -89.84 -56.02 3.4 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-O 123.229 1.49 . . . . 0.0 108.547 -5.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 101' ' ' MET . 76.4 m95 -77.06 -27.44 54.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 112.661 -2.063 . . . . 0.0 111.66 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -56.05 -58.76 6.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.895 -178.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.586 ' HB3' ' HG3' ' A' ' 96' ' ' GLU . 2.5 t80 -77.26 -33.46 55.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.838 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.469 ' HB3' ' HA ' ' A' ' 98' ' ' TRP . 1.8 tmt? -56.31 -49.52 74.07 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.395 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.8 mtm -74.66 -43.41 55.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -57.15 -43.63 82.67 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.829 0.347 . . . . 0.0 110.963 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.9 m -72.58 -46.78 52.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.31 -34.46 66.54 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.366 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -89.04 -30.41 18.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.003 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.04 -62.53 4.4 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.575 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 79.82 -76.61 1.99 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.415 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.43 -172.13 14.26 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.352 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -151.46 160.92 43.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.547 0.674 . . . . 0.0 110.335 -0.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 20.1 ptp180 -168.12 152.24 6.18 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.036 0.445 . . . . 0.0 111.336 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.404 HG21 ' HG2' ' A' ' 174' ' ' LYS . 86.2 m -79.93 145.27 32.73 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.105 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.29 131.19 35.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.659 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -115.34 142.7 46.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.199 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -62.81 134.44 56.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.053 0.454 . . . . 0.0 110.5 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.06 -14.4 63.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.986 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -81.53 141.1 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.085 0.469 . . . . 0.0 111.361 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.72 128.41 34.34 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.156 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -113.11 160.43 12.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.638 0.732 . . . . 0.0 112.73 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.439 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.2 tp -116.52 108.82 16.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.94 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.3 mt -96.62 116.45 29.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.675 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.589 ' NH2' HG21 ' A' ' 68' ' ' VAL . 55.1 ttp85 -102.49 116.95 33.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.749 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.445 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.5 t-80 -59.2 107.6 0.57 Allowed 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 177.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 35.1 t -48.47 -54.78 12.95 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.445 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.1 t80 -56.82 -70.05 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.415 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.6 p -63.18 -28.81 70.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 86.83 -5.44 84.98 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.92 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.0 mtt -80.18 -165.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.446 0.165 . . . . 0.0 110.703 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.46 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.3 m-85 -134.02 140.21 46.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.36 126.25 24.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.0 t -135.18 148.28 49.64 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.1 t -94.83 97.92 10.38 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.32 147.37 40.21 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.0 t -78.34 2.35 18.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.587 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 40.5 p -87.97 121.67 30.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.468 ' HB2' ' HA ' ' A' ' 141' ' ' ASP . 47.2 t -62.41 -60.41 3.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.578 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -172.42 70.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 88.1 p 48.02 31.16 2.31 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.218 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.0 p -162.88 -162.64 0.79 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.044 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 33.7 m -53.97 148.42 10.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.329 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.468 ' HA ' ' HB2' ' A' ' 136' ' ' SER . 2.8 p-10 -60.24 147.66 39.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.516 ' HG2' ' H ' ' A' ' 143' ' ' LEU . 11.7 ttmm -147.36 -157.56 0.82 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.83 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.516 ' H ' ' HG2' ' A' ' 142' ' ' LYS . 3.8 mm? -57.67 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.042 0.449 . . . . 0.0 111.524 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -84.19 151.68 24.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.835 -178.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -102.69 174.26 5.97 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.963 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -93.32 141.78 28.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.861 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 60.9 t -111.31 125.97 68.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -144.15 -150.69 5.3 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.757 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 66.5 mt -114.62 144.55 43.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.149 0.5 . . . . 0.0 110.969 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -137.29 137.95 39.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.677 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.45 -76.15 0.08 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.48 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -63.89 146.46 53.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.7 p -103.33 -0.66 29.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.035 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.8 p -54.97 112.26 1.01 Allowed 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.411 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 130.12 -161.55 23.08 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.52 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -118.68 -15.25 9.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 0.0 111.493 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.25 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.1 m -88.05 5.45 40.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.62 0.248 . . . . 0.0 111.613 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -110.88 132.69 53.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.103 0.478 . . . . 0.0 111.261 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.458 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.5 m95 -127.34 117.77 22.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.704 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.404 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 11.2 p -79.26 126.46 30.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.111 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.498 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.5 135.13 26.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.932 0.396 . . . . 0.0 110.976 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.436 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.2 m-70 -127.71 151.65 75.71 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.209 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.728 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.7 Cg_endo -68.07 140.31 49.36 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.519 2.146 . . . . 0.0 112.454 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.12 -47.27 52.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.843 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.458 ' HB3' ' NE2' ' A' ' 168' ' ' GLN . 62.2 m -111.82 -170.96 1.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.238 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.2 15.24 12.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.093 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.458 ' NE2' ' HB3' ' A' ' 166' ' ' SER . 2.4 mp0 -86.75 -35.18 19.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.21 0.529 . . . . 0.0 110.367 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -94.54 153.74 17.74 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.176 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.3 m -133.93 166.86 21.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.885 0.374 . . . . 0.0 111.342 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.03 132.2 48.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.524 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.39 -16.35 60.11 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.2 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -68.73 157.97 35.23 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.003 0.43 . . . . 0.0 111.158 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.404 ' HG2' HG21 ' A' ' 112' ' ' THR . 38.9 mttp -74.12 143.13 45.47 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.498 HG21 HD12 ' A' ' 162' ' ' ILE . 99.5 t -93.17 115.05 31.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.265 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.7 mpt_? -78.93 155.01 29.2 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-O 121.298 0.571 . . . . 0.0 111.615 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 39.0 t -69.42 121.13 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.47 -11.95 36.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.374 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -68.2 127.62 33.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.764 0.316 . . . . 0.0 110.731 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -69.7 110.36 4.85 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.489 HD21 HG13 ' A' ' 175' ' ' VAL . 71.2 mt -96.37 148.54 22.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.757 0.789 . . . . 0.0 113.127 -178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.436 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 54.5 mt -113.53 112.86 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -92.82 138.26 31.64 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.157 0.504 . . . . 0.0 112.052 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 191' ' ' TYR . 77.9 t -130.33 120.45 48.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.001 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 99.9 p -61.04 123.01 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.626 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 89.3 t -66.59 -33.19 61.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -76.04 -39.96 54.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.475 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 49.7 m -113.95 5.37 16.14 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.91 29.86 1.79 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 34.8 mtt85 -110.34 143.21 40.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.899 0.381 . . . . 0.0 110.838 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 56.5 m-85 -74.53 153.83 38.9 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.406 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.4 tp -75.68 76.22 2.67 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 105.322 -2.103 . . . . 0.0 105.322 175.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.1 t60 -76.4 151.79 36.46 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -174.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.7 tp -101.12 116.21 32.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 113.604 -1.635 . . . . 0.0 107.537 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.405 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 46.8 p -109.0 146.95 33.06 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -177.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -105.77 91.08 3.6 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.614 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.32 -174.17 40.62 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.329 -0.938 . . . . 0.0 111.594 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.53 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.7 m120 -3.09 -76.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.341 0.656 . . . . 0.0 112.496 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.0 p -147.39 14.3 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.064 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.2 t -128.12 -179.7 5.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.627 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -107.36 135.22 49.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.265 0.555 . . . . 0.0 111.294 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.614 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 12.4 m80 -127.93 176.79 7.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.01 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 203' ' ' VAL . . . . . 0.587 HG13 ' SG ' ' A' ' 47' ' ' CYS . 2.7 p -131.47 131.51 62.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.337 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.93 173.93 12.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.552 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.92 96.1 7.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.86 -179.51 3.65 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.252 -177.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -87.97 7.21 32.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.415 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 39.3 mt-30 -115.39 136.21 53.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.452 . . . . 0.0 110.687 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.42 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.7 mt-30 -64.57 174.68 1.65 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.371 1.081 . . . . 0.0 112.695 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -166.61 119.38 1.02 Allowed 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.093 -1.867 . . . . 0.0 107.826 178.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 47.7 mt -73.16 128.82 36.58 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.514 -0.474 . . . . 0.0 109.948 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.435 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.3 m95 -116.2 145.05 43.41 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.596 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.8 t -112.02 100.49 8.91 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.3 t -92.52 100.66 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.75 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.25 27.73 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.087 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 215' ' ' ALA . 25.5 Cg_exo -63.53 104.33 0.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.071 1.847 . . . . 0.0 111.029 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.495 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 5.7 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.368 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.871 0.367 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -120.7 153.13 37.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.53 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.4 mt -78.16 124.37 27.98 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.8 mmm180 -111.49 158.03 19.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.982 0.42 . . . . 0.0 111.087 -179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 p -68.09 155.23 40.01 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.889 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.1 -7.3 1.34 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.676 -179.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.2 m-20 -68.3 136.16 53.03 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.064 0.459 . . . . 0.0 110.974 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 13.5 tt0 -82.81 119.53 24.48 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.557 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.5 m -136.29 173.12 14.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.668 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.63 139.48 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.278 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.746 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -99.97 120.56 39.99 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.672 0.272 . . . . 0.0 110.67 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -123.07 142.14 51.2 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.454 0.645 . . . . 0.0 112.185 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 194' ' ' LEU . 19.6 t -127.92 146.66 50.57 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.866 178.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.0 m -87.98 122.34 31.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.267 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.613 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.76 122.64 47.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.347 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.2 m -125.68 140.21 52.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.447 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 tt -175.48 139.45 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.761 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.8 m80 57.86 43.19 21.99 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 60.27 23.73 13.14 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.296 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -126.52 123.13 37.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.607 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -117.53 151.25 37.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.195 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.45 ' HB2' HD21 ' A' ' 54' ' ' ASN . 24.9 pt20 -163.36 172.7 14.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.79 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HB2' ' OD1' ' A' ' 54' ' ' ASN . 29.2 mtmm -118.98 138.09 53.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.583 178.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -129.1 139.1 52.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.311 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.579 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 45.3 t -102.09 145.85 28.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.879 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -66.9 116.83 8.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.755 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.44 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . . . -116.48 162.44 17.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.591 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.22 165.56 21.87 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.753 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.58 144.49 39.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.569 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.91 51.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.436 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -123.24 147.59 46.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.847 0.356 . . . . 0.0 110.639 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.12 -139.81 21.58 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.411 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.85 4.66 13.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.72 0.295 . . . . 0.0 110.779 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.48 32.42 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.908 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.6 139.97 39.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.032 0.444 . . . . 0.0 110.472 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.6 m -79.73 151.14 30.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.556 0.693 . . . . 0.0 111.347 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -147.05 -167.85 2.89 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.622 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.7 mt -131.0 145.67 52.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 112.321 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 46.5 mt-10 -109.07 133.76 52.57 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.921 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.561 ' HA ' HD23 ' A' ' 35' ' ' LEU . 29.9 t -77.15 121.28 23.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.556 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 53.4 p -93.62 160.62 14.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.056 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.5 t -59.67 -19.93 52.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.836 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.524 ' H ' ' HA ' ' A' ' 57' ' ' ASN . 49.4 m-20 56.15 85.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.055 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.541 ' H ' ' C ' ' A' ' 56' ' ' LYS . 8.1 m -160.39 -67.75 0.07 Allowed 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 117.446 -1.264 . . . . 0.0 112.924 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 55' ' ' SER . 22.8 mtmt 48.34 77.58 0.09 Allowed 'General case' 0 C--N 1.369 1.42 0 C-N-CA 128.226 2.61 . . . . 0.0 114.598 -0.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.556 ' C ' ' HB ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -92.1 54.68 2.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.648 179.311 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 44.1 t -64.14 111.95 6.54 Favored Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.453 ' CA ' HG22 ' A' ' 52' ' ' THR . 7.8 Cg_exo -75.36 142.09 26.4 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.816 2.344 . . . . 0.0 110.832 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 51' ' ' SER . 3.3 Cg_endo -46.01 -36.08 15.44 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.662 2.241 . . . . 0.0 111.711 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -140.28 92.98 2.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.226 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 21' ' ' VAL . 57.4 tp -64.72 -32.59 74.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.836 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.523 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.2 t -51.58 -52.7 45.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.68 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 38' ' ' ALA . 37.9 pt -71.57 -14.46 17.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.668 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.53 -3.26 46.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.428 0.632 . . . . 0.0 110.059 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.492 HG22 ' OG ' ' A' ' 124' ' ' SER . 37.7 m -84.77 134.11 34.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.123 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -137.66 162.13 34.65 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.782 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.582 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -125.62 133.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.733 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 mt -82.32 63.77 6.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.5 mm-40 -43.7 -61.03 1.53 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -178.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.402 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 60.2 mm-40 -124.97 163.93 21.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.708 0.766 . . . . 0.0 112.977 -177.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.32 84.38 0.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.363 -1.29 . . . . 0.0 108.995 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.45 154.83 25.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.367 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.4 p -67.88 147.12 52.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.428 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.7 t -49.44 -44.99 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.088 0.47 . . . . 0.0 110.354 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -56.65 -54.21 48.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.227 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.77 97.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.9 tp -59.78 -49.3 78.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.065 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 96.7 mt-30 -62.76 -36.8 84.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.755 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -64.6 -44.04 91.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.946 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.7 mtt -62.01 -42.34 99.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.835 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.0 mt -68.92 -32.36 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.204 0.526 . . . . 0.0 110.36 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.57 69.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.661 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -76.1 -19.6 58.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.641 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 64.5 p -84.25 -6.41 59.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 0.0 111.296 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -79.6 -29.23 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.061 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -129.77 121.55 27.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 68.7 mttm 57.52 -168.16 0.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.986 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 65.6 m 61.99 105.98 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.082 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.53 169.51 17.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.074 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.22 31.63 41.72 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.829 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -68.6 -21.19 64.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 110.634 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.69 150.14 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.162 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 97' ' ' LYS . 6.9 p-10 -88.19 81.28 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.845 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.443 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.3 p -80.67 -1.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.719 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.787 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.3 mm-40 -53.72 -39.54 65.34 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.787 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -87.06 -50.77 6.42 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-N 120.45 1.477 . . . . 0.0 111.624 -2.721 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.635 ' H ' ' HG2' ' A' ' 97' ' ' LYS . 4.7 m-90 -66.24 -28.68 68.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.941 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.685 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -61.17 -39.47 90.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.174 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.737 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 36.3 t80 -74.28 -42.24 59.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.785 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.6 tpt -56.64 -49.42 75.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.932 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.2 mtm -71.54 -38.04 71.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -57.56 -45.76 84.75 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.859 0.361 . . . . 0.0 110.512 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.7 p -72.96 -39.28 66.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.701 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.02 69.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.074 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -91.75 -35.61 14.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.31 -18.15 78.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.266 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -139.31 61.89 0.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.953 -0.642 . . . . 0.0 112.476 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 157.69 166.7 17.53 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.395 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -75.65 -178.2 4.06 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.596 0.698 . . . . 0.0 110.83 -0.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -156.84 143.92 18.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.073 0.463 . . . . 0.0 111.533 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.408 HG21 ' HG2' ' A' ' 174' ' ' LYS . 93.3 m -75.76 148.09 38.77 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.052 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -81.34 131.63 35.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.837 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 77.9 mt -116.03 141.55 47.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.218 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -61.56 130.71 47.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.458 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.31 -12.7 60.15 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.037 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.99 141.53 32.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.12 0.485 . . . . 0.0 111.27 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.58 127.77 33.67 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.4 pt -112.77 159.42 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.556 0.693 . . . . 0.0 112.746 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.402 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.07 109.7 18.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.864 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.9 mt -97.4 116.97 30.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.629 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.582 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.4 ttp85 -103.4 116.01 31.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.777 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.5 t-80 -58.27 108.16 0.58 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 177.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.492 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -51.72 -48.33 63.64 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.523 ' HD1' ' HG ' ' A' ' 63' ' ' SER . 68.7 t80 -61.21 -64.63 0.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.439 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -72.12 -19.87 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.9 -0.19 73.06 Favored Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.236 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.6 mtt -83.32 -165.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.411 0.148 . . . . 0.0 110.636 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.478 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.2 m-85 -133.75 138.53 45.81 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.401 HD13 HD21 ' A' ' 37' ' ' LEU . 22.1 tp -55.39 127.4 29.35 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 177.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.586 ' SG ' HD21 ' A' ' 133' ' ' LEU . 20.5 p -137.02 150.01 47.83 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.0 t -95.36 99.53 11.45 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.589 -1.264 . . . . 0.0 107.589 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.586 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.2 mt -75.45 152.74 37.89 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.888 -178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.6 p -78.53 -5.71 53.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.81 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 31.1 p -85.32 124.16 31.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.729 0.299 . . . . 0.0 110.884 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 51.6 m -66.74 -60.9 2.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.864 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 179.34 -43.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.593 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 p -155.52 19.6 0.4 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.667 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.2 m 61.93 14.62 6.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.192 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 76.5 p -96.73 -5.94 37.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -148.38 169.41 20.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.985 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -134.29 2.91 3.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.995 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.05 -83.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -97.28 151.93 19.39 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.308 0.575 . . . . 0.0 111.948 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.506 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.0 m-85 -101.23 172.46 6.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.029 177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.06 142.93 27.23 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 62.9 t -111.48 117.52 55.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.383 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.35 -150.28 5.99 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.082 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.6 mt -115.14 146.36 41.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.036 0.446 . . . . 0.0 111.029 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.482 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 7.2 tp60 -137.62 143.65 41.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.705 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.37 -50.75 12.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -81.82 143.25 31.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 77.6 p -106.49 -6.66 17.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 110.978 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 66.8 p -54.84 114.23 1.64 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.46 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.28 -158.15 21.51 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.462 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.469 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.4 mt-10 -121.11 -12.48 8.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.765 0.317 . . . . 0.0 111.357 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.57 -32.15 68.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.122 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 79.7 m -90.86 6.2 45.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.718 0.295 . . . . 0.0 111.593 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -110.07 134.07 52.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.015 0.436 . . . . 0.0 111.365 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.474 ' O ' HG12 ' A' ' 119' ' ' ILE . 51.7 m95 -128.02 117.41 21.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.611 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.429 HG23 HG22 ' A' ' 186' ' ' VAL . 13.5 p -78.84 125.89 29.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.057 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.48 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.13 136.17 23.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.919 0.39 . . . . 0.0 110.89 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.42 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 74.6 m-70 -128.23 150.17 73.29 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.662 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.5 Cg_endo -66.16 137.58 48.51 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.377 2.051 . . . . 0.0 112.407 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.51 -40.93 41.13 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.289 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 58.6 m -103.49 -173.55 2.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.406 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 167' ' ' LYS . 14.0 tmtt? -95.22 -2.12 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.931 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.09 -33.31 44.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.035 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.662 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 58.7 mmt-85 -86.88 144.86 26.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.606 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 48.8 m -127.23 167.93 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.327 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.7 134.21 51.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.1 59.5 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.285 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -67.93 156.98 36.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.408 ' HG2' HG21 ' A' ' 112' ' ' THR . 63.3 mttt -73.56 141.68 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.366 178.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 162' ' ' ILE . 97.4 t -91.82 113.64 27.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.358 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -78.43 154.79 30.34 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.337 0.589 . . . . 0.0 111.57 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 48.0 t -69.96 122.16 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.322 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.26 -11.55 36.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.07 127.71 33.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.891 0.376 . . . . 0.0 110.935 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.439 ' HA ' ' O ' ' A' ' 212' ' ' TRP . 6.8 m-20 -69.82 114.02 7.61 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 175' ' ' VAL . 70.1 mt -99.78 149.5 23.29 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.481 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.9 mt -114.3 112.3 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -92.24 138.12 31.79 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.063 0.459 . . . . 0.0 112.048 -178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.474 HG22 ' CD1' ' A' ' 191' ' ' TYR . 80.0 t -130.48 127.99 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.709 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.8 m -64.59 123.16 18.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.469 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.2 t -67.44 -30.26 48.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.832 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.9 t -79.13 -38.38 36.22 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.461 ' HB2' HH11 ' A' ' 190' ' ' ARG . 94.2 p -120.52 10.61 11.17 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 45.29 33.07 1.12 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 39.1 mtt85 -109.01 138.39 45.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.961 0.41 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.5 m-85 -72.2 153.06 41.83 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.404 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.4 tp -75.28 75.5 2.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 175.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -74.15 151.12 40.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -174.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.2 tp -101.53 115.8 31.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.721 -1.582 . . . . 0.0 107.645 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.4 p -109.28 145.83 35.3 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -105.7 92.45 4.18 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.594 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.73 -174.3 46.39 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.266 -0.968 . . . . 0.0 111.368 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 39.6 m-80 -1.14 -78.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.298 0.639 . . . . 0.0 112.52 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.6 p -146.68 12.87 1.16 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.07 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 49.9 m -126.74 -178.45 4.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.613 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.0 m95 -108.53 135.47 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.281 0.563 . . . . 0.0 111.328 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.594 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 14.9 m80 -127.66 175.33 8.37 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.064 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.23 133.69 63.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.443 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.7 172.15 16.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.605 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -98.77 95.99 7.59 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.93 179.18 4.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.325 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -87.21 8.16 25.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.835 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.456 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 37.2 mt-30 -114.16 134.98 54.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.721 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.481 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.4 mt-30 -64.05 174.32 1.58 Allowed 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.296 1.046 . . . . 0.0 112.742 -178.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.2 m -167.85 121.6 0.94 Allowed 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 113.102 -1.863 . . . . 0.0 107.912 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.422 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 41.1 mt -76.37 130.31 37.88 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.122 0.487 . . . . 0.0 109.885 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.439 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.1 m95 -117.54 147.58 42.66 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.705 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -114.02 99.19 7.46 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.377 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.746 HG22 ' HG ' ' A' ' 22' ' ' LEU . 94.8 t -91.85 100.78 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.759 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.83 140.69 25.76 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.092 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 19' ' ' GLU . 27.9 Cg_exo -62.1 104.69 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.079 1.853 . . . . 0.0 111.251 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.557 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.235 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.875 0.369 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -120.84 158.12 28.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.242 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.7 mt -81.96 120.5 25.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.494 HH21 ' H ' ' A' ' 109' ' ' GLY . 7.8 mmm180 -109.12 158.65 17.58 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.99 0.424 . . . . 0.0 111.035 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 p -67.75 157.22 35.19 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.793 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 69.03 -2.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.877 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -74.25 134.36 42.66 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.468 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -79.68 119.37 22.52 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.533 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.9 m -136.88 169.64 19.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.663 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -132.22 140.28 48.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 108.398 176.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.769 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.22 122.01 42.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.691 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 39.0 mt-30 -122.15 151.77 40.62 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.527 0.679 . . . . 0.0 111.889 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.1 p -137.57 140.8 41.23 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.808 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -83.26 122.82 28.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.157 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.622 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.81 120.96 40.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.4 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.3 m -125.66 140.15 52.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.428 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.1 tt -175.71 143.13 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.642 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.1 m80 58.09 39.23 26.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.749 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.25 26.22 15.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.049 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -129.26 122.84 30.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.575 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -116.02 149.15 39.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -161.16 174.15 14.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.67 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 18.5 mtpp -120.98 135.19 55.27 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.504 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.2 mt -125.18 142.33 51.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.568 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 43.8 t -106.44 142.97 35.23 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.894 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD21 HD13 ' A' ' 130' ' ' LEU . 27.0 tp -63.49 115.61 4.81 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.795 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.19 164.69 14.11 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.683 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.82 165.47 9.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.683 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.93 144.64 39.15 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.627 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -82.26 17.55 17.83 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.662 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -126.75 151.95 47.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 0.0 110.446 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.15 -135.86 15.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.262 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 8.1 p30 -85.56 8.12 20.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.706 0.289 . . . . 0.0 110.78 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.0 29.23 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.922 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.11 142.25 38.21 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 120.974 0.416 . . . . 0.0 110.55 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.62 151.4 25.34 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.512 0.672 . . . . 0.0 111.098 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 64' ' ' ILE . 21.9 p90 -144.9 -167.58 2.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.763 -1.108 . . . . 0.0 108.555 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.36 142.6 50.1 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.402 -0.519 . . . . 0.0 112.305 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 48.1 mt-10 -106.19 134.61 49.06 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.158 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.563 ' HA ' HD23 ' A' ' 35' ' ' LEU . 59.2 m -78.92 125.73 29.76 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.571 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 57.8 p -94.68 157.93 15.74 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 120.034 -0.666 . . . . 0.0 111.24 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -67.1 -9.43 39.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.548 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.407 ' C ' ' H ' ' A' ' 57' ' ' ASN . 85.1 m-20 59.93 14.29 4.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.941 0.4 . . . . 0.0 110.825 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 66.1 p -154.04 76.05 1.04 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.873 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 24.8 ttmm -109.09 94.2 4.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.957 0.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.571 ' C ' ' HB ' ' A' ' 52' ' ' THR . 84.9 m-20 55.95 22.03 5.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.313 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 30.2 t -63.8 107.91 1.55 Allowed Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 11.9 Cg_exo -73.89 141.36 30.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.104 2.536 . . . . 0.0 111.106 177.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.81 -37.48 35.95 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.497 2.131 . . . . 0.0 111.654 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -135.3 93.73 3.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.535 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.504 HD11 HG11 ' A' ' 21' ' ' VAL . 50.5 tp -66.28 -34.12 77.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.13 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.463 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.4 t -50.07 -51.09 45.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.744 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.408 HD12 ' CZ ' ' A' ' 48' ' ' PHE . 33.2 pt -72.05 -15.97 18.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.887 0.375 . . . . 0.0 111.593 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.663 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.97 -1.52 45.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.339 0.59 . . . . 0.0 110.307 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.494 HG22 ' OG ' ' A' ' 124' ' ' SER . 34.0 m -85.92 135.65 33.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.022 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.16 161.88 36.32 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -125.73 132.88 70.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.65 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.419 HD23 ' CD2' ' A' ' 121' ' ' LEU . 15.4 mt -82.01 66.93 7.8 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.2 mm-40 -46.28 -62.5 1.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.405 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.2 mm100 -121.67 165.72 15.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.667 0.746 . . . . 0.0 112.963 -177.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -158.93 82.72 0.79 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.9 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -111.37 156.55 21.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.413 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.0 t -69.77 147.15 50.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.22 -45.33 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.477 . . . . 0.0 110.254 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 ttp85 -55.5 -54.72 40.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.295 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.41 -45.17 94.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.015 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.0 tp -59.93 -46.54 89.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.394 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.99 -34.78 78.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.928 0.394 . . . . 0.0 110.772 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.77 -41.45 87.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.865 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.3 mtt -63.43 -44.05 95.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -69.66 -34.39 73.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.881 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.73 75.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -72.78 -25.35 61.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.0 p -81.66 0.87 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 111.207 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.9 t -82.85 -27.87 8.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.985 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -116.11 -70.66 0.78 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.046 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -165.16 144.87 6.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.064 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 65.0 m -146.4 -81.65 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.021 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 59.29 105.27 0.02 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.289 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 115.87 35.55 1.24 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.446 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.13 -15.45 59.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.847 0.355 . . . . 0.0 111.006 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -74.93 -168.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.406 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.581 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 5.3 m-20 -55.49 109.68 0.59 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.003 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.37 -15.42 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.033 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.77 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.6 mm-40 -53.88 -45.37 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 118.861 -0.59 . . . . 0.0 112.224 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.7 ptmt -86.55 -44.15 12.15 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.971 1.308 . . . . 0.0 110.826 -3.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -53.35 -49.42 67.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.219 -1.355 . . . . 0.0 112.731 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.527 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 55.3 mtpt -55.48 -30.59 60.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.667 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.77 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.2 t80 -73.81 -48.23 32.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.026 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.09 -42.51 85.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.11 -39.43 72.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.653 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -60.61 -39.91 89.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.542 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.6 m -72.39 -49.16 35.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.256 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.98 78.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.495 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -79.88 -28.7 39.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.015 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.91 -34.89 88.53 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -169.95 -176.03 39.34 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.452 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.494 ' H ' HH21 ' A' ' 15' ' ' ARG . . . -142.09 72.88 0.38 Allowed Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.73 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -87.16 -31.53 20.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 117.575 0.687 . . . . 0.0 111.048 -0.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -166.93 143.28 4.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.022 0.439 . . . . 0.0 111.462 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.5 m -75.81 148.38 38.46 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.027 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -81.74 129.58 34.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -114.92 143.13 45.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.252 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -62.57 133.23 54.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.024 0.44 . . . . 0.0 110.471 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.7 -11.64 64.59 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.048 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.441 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.09 139.74 32.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.982 0.42 . . . . 0.0 111.356 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.42 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.26 128.71 34.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.8 pt -113.39 159.22 13.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.547 0.689 . . . . 0.0 112.792 -178.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.405 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.0 tp -115.4 108.39 16.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.858 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.419 ' CD2' HD23 ' A' ' 69' ' ' LEU . 48.3 mt -95.76 118.11 31.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.665 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 19.7 ttp180 -103.75 115.36 30.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.669 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.494 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.1 t-80 -57.44 109.5 0.7 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.494 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -52.75 -48.81 66.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.494 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 77.4 t80 -61.6 -62.5 1.76 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.443 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.7 p -73.26 -20.74 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.81 -1.23 74.46 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.084 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.3 mtt -83.37 -165.92 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 60.0 m-85 -133.03 139.06 47.02 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.479 HD13 HD21 ' A' ' 37' ' ' LEU . 24.2 tp -54.42 129.53 36.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.4 t -138.81 147.32 42.39 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.6 t -94.04 98.05 10.74 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -73.74 156.83 37.46 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.559 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.0 m -81.61 -10.38 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.432 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -87.13 123.75 32.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.711 0.291 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 57.9 m -71.0 -60.38 2.26 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.961 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.513 ' HG3' ' H ' ' A' ' 138' ' ' SER . 10.7 ptm180 -176.11 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.157 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.513 ' H ' ' HG3' ' A' ' 137' ' ' ARG . 57.8 p -175.32 -66.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.047 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.4 m -75.42 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.063 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.7 p -72.13 169.48 15.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.214 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.436 ' HA ' ' OG ' ' A' ' 136' ' ' SER . 4.4 p30 -167.72 25.38 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -143.02 -41.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.754 -179.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 143' ' ' LEU . 3.8 mm? -60.2 -89.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -109.09 149.85 28.69 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.326 0.584 . . . . 0.0 111.759 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 15.7 m-85 -103.17 169.43 8.56 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.928 178.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -88.26 144.09 26.64 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 99.1 t -113.51 116.09 51.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.463 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.72 -147.89 5.76 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.323 -0.941 . . . . 0.0 112.695 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 70.2 mt -116.3 153.49 31.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.828 0.346 . . . . 0.0 110.618 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -143.62 139.21 29.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.81 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.96 -69.24 0.36 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.473 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.75 143.77 51.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.589 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.401 HG21 HD21 ' A' ' 120' ' ' LEU . 52.3 p -103.15 1.32 33.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.349 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -56.23 115.12 2.27 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.56 -161.89 18.9 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.613 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.487 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 33.8 mt-10 -117.07 -11.25 10.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.815 0.341 . . . . 0.0 111.273 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.71 67.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 83.8 m -92.22 9.45 33.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.22 132.5 54.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.099 0.476 . . . . 0.0 111.361 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.4 m95 -127.45 117.15 21.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.597 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 7.4 p -79.06 128.14 32.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.267 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.528 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -89.48 133.41 31.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 111.052 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.464 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 81.4 m-70 -126.57 150.15 69.99 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.2 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.702 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.3 Cg_endo -67.54 137.52 42.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.519 2.146 . . . . 0.0 112.065 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.29 -43.42 56.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.688 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 54.9 m -106.88 -174.04 2.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.039 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.63 8.06 40.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.157 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -83.83 -34.67 24.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.853 -179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.702 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -90.02 148.23 23.19 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.531 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 51.1 m -128.13 167.15 17.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.98 135.76 55.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 89.29 -16.88 54.85 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.395 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 23.8 mt-10 -67.41 154.97 40.13 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.924 0.393 . . . . 0.0 111.161 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -71.87 142.15 49.56 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 178.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.528 HG21 HD12 ' A' ' 162' ' ' ILE . 92.5 t -91.53 113.03 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.755 0.312 . . . . 0.0 110.412 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -75.51 152.96 37.75 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.34 0.591 . . . . 0.0 111.5 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.444 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.6 t -68.94 121.43 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.69 -11.9 35.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.342 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.36 130.34 42.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.831 0.348 . . . . 0.0 110.905 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 13.2 m-20 -71.95 112.18 7.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 76.5 mt -98.13 150.07 21.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.521 HD13 ' NE2' ' A' ' 209' ' ' GLN . 51.4 mt -114.32 112.89 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -92.75 136.28 33.38 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.191 0.52 . . . . 0.0 112.129 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.453 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.7 t -128.74 126.27 64.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.862 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 5.3 m -63.93 125.47 24.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -70.63 -32.05 48.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.682 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.7 t -81.21 -36.31 30.23 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 53.1 m -114.98 5.51 15.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 45.22 33.16 1.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -116.09 142.47 46.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.989 0.424 . . . . 0.0 110.772 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.8 m-85 -72.6 153.84 41.06 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 27.3 tp -75.31 76.45 2.41 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 175.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -75.54 150.74 38.05 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -174.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -101.59 114.39 28.39 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.705 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.419 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 48.2 t -107.88 146.24 32.6 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -177.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -106.41 91.2 3.6 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.02 -179.73 52.98 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.032 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 35.1 m-80 7.65 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.23 0.612 . . . . 0.0 112.386 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 49.7 m -142.19 5.71 1.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.349 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.1 m -120.89 -179.31 3.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.206 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.622 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.6 m95 -106.27 139.3 40.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.274 0.559 . . . . 0.0 111.198 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.518 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 18.8 m80 -130.26 172.08 12.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.962 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.88 132.6 69.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.295 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.419 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.8 p30 -150.31 170.19 19.6 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.588 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.49 93.77 6.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.307 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.07 175.8 5.29 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.268 -177.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.02 10.66 9.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.195 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 14.0 mm100 -117.6 136.5 53.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.684 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.521 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.3 mt-30 -64.56 175.61 1.35 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.434 1.111 . . . . 0.0 113.151 -178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.7 m -169.49 120.07 0.68 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 112.919 -1.946 . . . . 0.0 107.721 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 31.6 mt -74.76 128.91 36.71 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.923 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.35 144.88 43.1 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.566 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.9 t -112.44 101.18 9.37 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.428 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.769 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.6 t -92.68 100.48 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.779 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -111.46 142.15 25.92 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.446 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.1 Cg_exo -63.68 103.73 0.41 Allowed 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.209 1.939 . . . . 0.0 111.365 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.533 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.926 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -120.35 153.61 36.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.54 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.6 mt -80.73 122.59 27.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.4 mmm180 -109.75 157.29 19.29 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 111.182 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.409 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.1 p -67.82 156.45 37.07 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.763 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.74 -9.9 1.03 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.69 -179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.9 m-20 -67.72 134.09 50.45 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -79.8 120.41 24.03 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.471 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.7 m -136.35 172.99 14.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -135.16 139.23 47.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.304 176.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.779 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.2 mp -100.04 122.62 43.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.529 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -123.04 146.02 48.03 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.625 0.726 . . . . 0.0 112.223 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -131.38 142.56 50.07 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.752 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.7 m -84.25 120.95 26.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.322 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.588 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.99 117.51 31.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.216 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.1 m -122.02 137.02 54.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.023 0.44 . . . . 0.0 111.731 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -171.89 144.8 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.496 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.3 m80 60.19 34.84 21.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt 64.19 25.43 13.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.133 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -128.37 126.66 41.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.177 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -116.26 141.86 47.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 111.571 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -151.59 174.39 13.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.633 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.523 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 27.7 mtmm -122.28 135.54 54.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.645 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -124.62 141.58 51.99 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.523 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.3 t -104.76 142.34 34.89 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.684 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.49 ' HA ' HD23 ' A' ' 49' ' ' LEU . 35.7 tp -60.93 112.93 2.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.684 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.426 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.73 163.4 14.19 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.515 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.73 160.21 10.39 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.405 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.7 141.85 48.78 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.622 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.414 ' HA2' ' CE ' ' A' ' 128' ' ' MET . . . -81.82 16.36 21.11 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.193 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -122.13 148.52 44.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 0.0 110.714 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.58 -138.39 20.24 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.583 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -81.54 8.83 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.644 0.259 . . . . 0.0 110.971 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.08 31.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.249 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.9 mt -78.31 138.65 38.69 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 110.556 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.3 m -79.86 151.47 30.19 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.631 0.729 . . . . 0.0 111.413 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.71 -161.9 1.42 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.558 -1.201 . . . . 0.0 108.348 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.5 mt -132.89 145.36 50.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.0 112.066 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.4 tt0 -112.69 139.36 48.36 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.526 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.46 ' HA ' HD23 ' A' ' 35' ' ' LEU . 39.5 t -78.92 144.06 35.24 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.461 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 61.6 p -104.89 153.99 20.65 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.908 0.385 . . . . 0.0 110.488 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.479 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 29.1 t -51.7 -19.36 1.56 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.605 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 66.44 150.45 0.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.175 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 66.8 m 53.55 70.36 0.6 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.989 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' A' ' 56' ' ' LYS . 4.0 mppt? -82.12 -51.23 8.18 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 122.805 0.442 . . . . 0.0 111.097 -0.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.523 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -162.96 -96.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.052 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.0 t 61.36 101.33 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HG3' HG22 ' A' ' 52' ' ' THR . 11.0 Cg_exo -72.18 139.1 31.81 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 123.109 2.539 . . . . 0.0 111.457 178.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.423 ' HD2' ' O ' ' A' ' 51' ' ' SER . 10.1 Cg_endo -51.85 -37.59 66.44 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.288 1.992 . . . . 0.0 111.451 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -122.84 84.82 2.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.783 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.623 HD11 HG11 ' A' ' 21' ' ' VAL . 44.8 tp -65.74 -30.44 71.1 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.3 p -46.83 -51.87 15.56 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.426 HD12 ' HB1' ' A' ' 38' ' ' ALA . 32.1 pt -71.38 -17.32 19.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.19 -1.33 42.35 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.937 0.399 . . . . 0.0 111.452 -179.233 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.487 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.1 m -84.66 132.9 34.42 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -137.07 162.91 32.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.971 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -126.27 133.92 67.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 HG11 ' A' ' 20' ' ' VAL . 18.4 mt -82.64 66.55 8.3 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.7 mm-40 -45.5 -64.62 0.69 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.453 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 55.9 mm-40 -122.98 165.26 17.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.773 0.797 . . . . 0.0 113.033 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.8 m -156.11 86.12 1.03 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.114 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.5 mt -112.96 157.09 21.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.514 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.7 t -69.65 146.86 51.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.9 t -50.36 -45.73 25.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.12 0.486 . . . . 0.0 110.236 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -57.18 -51.57 68.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.218 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -62.19 -44.63 96.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.789 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.72 -46.75 89.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.263 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -67.29 -33.6 75.64 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.925 0.393 . . . . 0.0 110.569 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.21 -41.99 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.551 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.9 mtt -64.72 -42.44 95.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.69 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.36 -32.68 71.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.656 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.29 -31.73 69.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.534 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -73.64 -17.19 61.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.244 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.6 p -92.45 -7.78 46.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.725 0.297 . . . . 0.0 111.417 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.1 t -72.39 -40.42 64.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.139 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -87.0 -174.38 4.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.773 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -60.37 -68.93 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 66.2 m 57.07 98.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.502 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -104.78 100.4 10.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.96 24.92 70.47 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.598 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -130.42 113.87 14.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.786 0.326 . . . . 0.0 110.758 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.2 p -157.63 -10.37 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.425 ' HB3' ' HG2' ' A' ' 96' ' ' GLU . 9.3 m-20 -112.03 93.02 4.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.609 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.7 p -77.3 2.73 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-O 121.156 0.503 . . . . 0.0 111.353 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.713 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.8 OUTLIER -52.26 -48.99 64.93 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.916 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 89.9 mttt -89.38 -57.61 2.82 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 123.068 1.414 . . . . 0.0 108.843 -5.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -77.8 -27.39 50.11 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 112.873 -1.967 . . . . 0.0 111.655 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.0 -59.2 5.41 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.249 -0.58 . . . . 0.0 111.068 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.555 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.5 t80 -77.33 -36.01 54.27 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.919 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.4 ttt -57.26 -38.53 74.01 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.082 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.5 ttt -76.64 -42.8 40.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -57.0 -42.43 80.26 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.844 0.354 . . . . 0.0 110.249 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -72.52 -44.37 62.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.655 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.35 -31.84 66.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -80.04 -48.91 12.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.83 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.58 67.36 0.19 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.671 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -66.01 -59.13 7.8 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.89 165.06 27.94 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.413 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 42.1 m-70 -83.46 176.21 9.23 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.553 0.676 . . . . 0.0 110.753 0.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -141.09 144.94 35.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.054 0.454 . . . . 0.0 111.625 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.3 m -77.45 147.35 35.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.17 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.42 130.84 35.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 84.2 mt -114.98 142.35 46.75 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.226 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -63.17 132.37 51.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.977 0.418 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.47 -15.64 59.79 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.979 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -80.51 141.63 34.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.102 0.477 . . . . 0.0 111.568 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.02 127.32 33.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.132 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.0 pt -112.01 162.82 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.492 0.663 . . . . 0.0 112.761 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.453 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.9 tp -118.73 109.99 16.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.949 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -98.0 117.77 33.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.615 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.483 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.7 ttp-105 -104.08 116.15 31.7 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.438 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.2 t-80 -58.11 109.06 0.68 Allowed 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.487 ' OG ' HG22 ' A' ' 66' ' ' THR . 69.9 m -50.07 -54.13 22.43 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.438 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 46.7 t80 -57.54 -69.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.411 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.5 p -62.76 -29.39 70.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.73 -1.82 88.01 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.085 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' MET . . . . . 0.414 ' CE ' ' HA2' ' A' ' 41' ' ' GLY . 64.1 mtm -85.29 -165.69 1.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.193 . . . . 0.0 110.575 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 59.0 m-85 -132.27 140.07 48.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.463 HD13 HD21 ' A' ' 37' ' ' LEU . 24.7 tp -55.03 128.46 33.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 177.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.8 t -137.97 147.7 44.51 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -176.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -94.58 97.98 10.5 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.502 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.2 mt -74.71 155.45 37.69 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.341 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -85.72 3.97 38.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.928 -178.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 64.2 p -92.2 123.72 35.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.649 0.262 . . . . 0.0 110.977 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 54.8 m -64.13 -60.9 2.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.682 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.403 ' HG3' ' N ' ' A' ' 138' ' ' SER . 15.1 ptp180 179.66 -48.74 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.899 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.403 ' N ' ' HG3' ' A' ' 137' ' ' ARG . 48.1 t -164.53 -81.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.965 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -156.87 -1.25 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.134 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 30.6 m -63.22 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.314 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -111.11 -175.44 2.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.792 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -137.32 -5.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.079 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.473 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 3.6 mm? -60.24 -92.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.02 0.438 . . . . 0.0 110.843 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . -58.6 142.48 49.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.493 0.664 . . . . 0.0 112.236 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 18.8 m-85 -101.81 173.03 6.59 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.963 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -90.98 141.99 28.25 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.7 117.68 55.71 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.346 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.84 -150.66 6.13 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.769 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 72.3 mt -114.39 148.43 37.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.902 0.382 . . . . 0.0 110.618 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -135.22 141.58 45.83 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.39 -58.7 3.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.71 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -82.64 151.69 26.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.883 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.7 p -107.33 -3.19 19.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.162 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.8 p -56.71 113.02 1.46 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.14 -159.02 22.23 Favored Glycine 0 N--CA 1.442 -0.965 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.517 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 42.1 mt-10 -120.63 -12.54 8.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.781 0.324 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.87 -32.24 67.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.214 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.0 m -92.17 9.1 35.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -111.69 131.45 55.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.147 0.498 . . . . 0.0 111.408 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -126.47 117.52 23.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.775 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -79.07 126.4 30.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.101 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.466 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -88.56 135.17 26.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.855 0.359 . . . . 0.0 111.009 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.486 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 74.5 m-70 -127.25 151.58 74.8 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.149 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.5 Cg_endo -67.6 138.83 46.76 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.554 2.169 . . . . 0.0 112.275 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.72 -42.38 41.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.447 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 36.4 m -105.01 -173.09 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.416 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -95.41 6.92 47.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.475 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -86.23 -34.26 20.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.947 0.403 . . . . 0.0 110.792 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.4 mmp_? -86.78 146.52 26.21 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 33.9 t -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.429 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.84 129.08 38.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.253 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.24 -13.61 64.44 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.999 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.8 158.47 36.03 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.943 0.401 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -74.09 143.16 45.51 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.466 HG21 HD12 ' A' ' 162' ' ' ILE . 89.8 t -93.48 114.93 31.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.264 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -80.74 155.0 26.93 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 121.325 0.583 . . . . 0.0 111.709 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.84 122.82 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.54 -18.0 27.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.922 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -66.88 128.79 37.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.746 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.457 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.3 m-20 -72.99 116.54 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.429 HD21 HG13 ' A' ' 175' ' ' VAL . 61.7 mt -99.73 149.43 23.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.486 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 56.2 mt -114.31 112.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 176.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.71 137.61 32.21 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.177 0.513 . . . . 0.0 112.278 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.443 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.7 t -130.41 124.21 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.841 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 32.2 t -63.06 127.46 31.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 97.7 t -71.39 -32.26 46.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 120.896 0.379 . . . . 0.0 110.814 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.1 p -78.91 -39.42 34.87 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.477 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 55.1 m -114.06 4.91 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.32 31.15 1.7 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.301 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.473 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 0.3 OUTLIER -112.32 144.18 42.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.93 0.395 . . . . 0.0 110.69 179.868 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.474 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.8 m-85 -74.15 152.57 39.81 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 41.3 tp -75.15 77.6 2.3 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -77.75 150.44 34.38 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -174.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.8 tp -100.1 119.16 37.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.532 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.3 t -113.01 147.19 37.69 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.55 90.17 3.25 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.581 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.09 -175.03 46.32 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.17 -1.014 . . . . 0.0 111.437 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 34.8 m-80 1.11 -78.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.368 0.667 . . . . 0.0 112.496 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 34.6 t -147.05 11.38 1.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 52.2 m -125.88 -178.97 4.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.982 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.588 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.2 135.6 48.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.21 0.528 . . . . 0.0 111.195 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.581 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 18.1 m80 -127.23 174.73 8.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.79 130.07 66.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.283 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -147.05 172.31 13.93 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.606 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.26 92.31 5.38 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.61 179.64 4.02 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.562 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -88.11 11.38 16.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.298 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -119.6 137.65 53.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.697 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.31 175.58 1.28 Allowed 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 122.352 1.072 . . . . 0.0 112.997 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.8 m -169.36 119.84 0.69 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.794 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 39.6 mt -74.36 129.41 37.74 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.045 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.412 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.9 m95 -116.04 146.77 41.9 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.449 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -115.02 101.89 9.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.318 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.779 HG22 ' HG ' ' A' ' 22' ' ' LEU . 61.9 t -93.49 101.58 12.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.975 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.0 143.23 29.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.098 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.38 105.26 0.59 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.237 1.958 . . . . 0.0 111.366 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.471 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.94 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -119.17 157.36 28.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.504 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.8 mt -80.11 122.47 26.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 178.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.2 mmm180 -111.71 158.05 19.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.186 0.517 . . . . 0.0 111.315 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -68.06 155.79 38.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.7 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 16' ' ' THR . 7.5 m-20 71.18 -3.46 2.06 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.841 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.431 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.7 m-20 -72.74 138.35 46.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -84.74 119.39 25.22 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.5 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -135.83 170.54 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -177.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.564 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.66 135.91 58.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.267 176.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.777 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -97.04 123.06 40.67 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.519 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.477 ' OE1' ' HB2' ' A' ' 57' ' ' ASN . 38.2 mt-30 -120.2 164.83 15.63 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.275 0.56 . . . . 0.0 111.355 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -151.82 142.88 23.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.49 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -86.99 119.73 27.5 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.43 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.11 119.84 39.23 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.851 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.7 m -123.88 132.01 53.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 112.037 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.528 HG23 ' CD2' ' A' ' 29' ' ' HIS . 17.7 tt -168.9 148.94 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.446 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.528 ' CD2' HG23 ' A' ' 28' ' ' ILE . 47.7 m-70 58.23 42.0 22.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 59.82 23.21 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.28 179.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -126.5 145.68 50.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.412 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -130.71 142.52 50.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.924 0.392 . . . . 0.0 111.2 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.492 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -153.9 171.55 18.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.853 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 34' ' ' LYS . 17.3 mtpp -120.39 138.18 53.9 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.419 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.14 145.43 50.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.21 137.62 46.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.987 0.423 . . . . 0.0 110.549 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.555 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -60.83 111.69 1.75 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.168 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.438 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.56 165.54 11.73 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.417 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.89 162.02 11.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.802 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.57 148.09 50.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.7 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.9 -0.57 89.77 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.737 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -112.22 158.02 20.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.841 0.353 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.36 -136.15 16.18 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.464 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.435 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 1.2 p30 -87.12 7.86 26.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.695 0.283 . . . . 0.0 110.877 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.87 28.84 0.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.323 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.8 mt -79.41 141.13 37.13 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.2 m -80.93 150.04 29.15 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.476 0.655 . . . . 0.0 111.245 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -144.14 -168.72 2.95 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.743 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.555 HD23 ' HA ' ' A' ' 37' ' ' LEU . 22.7 mt -130.94 144.53 51.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.422 0.63 . . . . 0.0 112.361 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.2 mt-10 -109.12 138.44 45.47 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.819 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.567 ' HA ' HD23 ' A' ' 35' ' ' LEU . 49.7 m -81.73 134.93 35.5 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 176.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 62.0 p -105.82 165.06 11.45 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.629 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.8 m -73.47 -10.96 60.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.007 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.42 ' C ' ' H ' ' A' ' 57' ' ' ASN . 63.7 m-20 61.75 13.47 5.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.982 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 58.6 m -155.76 76.05 0.93 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.14 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 47.5 pttt -106.29 100.19 9.74 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.246 0.618 . . . . 0.0 110.774 -0.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.557 ' C ' ' HB ' ' A' ' 52' ' ' THR . 10.6 p30 44.8 24.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.9 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 94.4 t -64.4 108.5 1.97 Allowed Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 5.0 Cg_exo -79.7 140.23 14.62 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.839 2.359 . . . . 0.0 111.193 177.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -49.22 -40.33 42.71 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.115 . . . . 0.0 111.397 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.419 ' O ' HG12 ' A' ' 64' ' ' ILE . 13.0 t70 -128.78 92.63 3.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.709 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.564 HD11 HG11 ' A' ' 21' ' ' VAL . 50.1 tp -70.19 -29.22 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.009 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.3 m -52.32 -46.52 66.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -70.92 -20.34 21.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 57.1 m -97.71 13.02 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.072 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.505 HG22 ' OG ' ' A' ' 124' ' ' SER . 25.8 m -91.36 130.37 37.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.15 0.5 . . . . 0.0 111.91 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.06 161.53 35.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.108 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.66 133.34 69.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.609 178.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.1 mt -81.49 65.5 6.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.8 mm-40 -44.55 -60.23 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.406 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 58.2 mm-40 -126.42 163.67 22.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.706 0.765 . . . . 0.0 112.839 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.6 t -155.43 84.06 1.05 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.476 -1.238 . . . . 0.0 108.999 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -111.73 152.65 27.52 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.33 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.4 t -65.4 148.55 51.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -50.44 -46.09 26.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.027 0.441 . . . . 0.0 110.288 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -55.55 -57.56 11.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.129 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.35 -44.76 84.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.177 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.8 -50.88 72.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.104 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -62.31 -34.57 76.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.629 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -65.74 -43.53 88.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.851 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.1 mtt -60.71 -47.08 87.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.904 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' O ' HG23 ' A' ' 86' ' ' VAL . 60.0 mt -67.43 -34.9 78.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.981 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.95 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -69.91 -17.99 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.588 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 68.8 p -90.31 -13.69 34.7 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.716 0.293 . . . . 0.0 111.359 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 82' ' ' LEU . 19.9 t -78.32 -49.01 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.89 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -92.29 -179.36 5.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 56.67 -167.67 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.9 t -146.1 -15.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.968 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -140.01 179.17 6.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 111.98 -15.29 26.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.458 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 56.36 -169.2 0.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.91 0.386 . . . . 0.0 111.156 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.4 t -73.41 -26.95 22.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.957 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.457 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 10.8 m-20 -83.27 84.78 7.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.81 -2.53 6.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.782 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 31.8 mm-40 -54.23 -44.23 71.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.735 -0.65 . . . . 0.0 112.37 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.723 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 26.1 ttmt -86.64 -50.6 6.68 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.363 1.465 . . . . 0.0 111.487 -2.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 51.6 t-105 -54.86 -36.68 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.319 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 88.0 tttt -65.75 -32.82 74.58 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.771 -178.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.782 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -74.1 -49.37 24.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.999 0.428 . . . . 0.0 109.885 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 53.7 ttp -61.06 -37.94 84.42 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.763 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttp -73.41 -40.19 64.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.983 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -61.34 -45.21 95.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.788 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 48.9 p -70.85 -45.27 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.292 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.88 -31.08 72.05 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.257 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -78.33 -60.54 2.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.973 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -145.63 57.06 0.52 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.72 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.98 -42.21 94.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.403 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -146.08 165.23 28.18 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.482 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -78.51 -177.96 5.57 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.547 0.673 . . . . 0.0 110.917 -0.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 19.2 ptp180 -149.45 149.56 30.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.047 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.479 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 75.0 m -78.45 147.02 34.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.286 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.0 131.55 35.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.679 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 75.2 mt -115.29 143.39 45.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.046 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -62.79 132.68 53.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.041 0.448 . . . . 0.0 110.554 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.91 -11.84 64.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.039 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.93 141.42 32.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.038 0.447 . . . . 0.0 111.267 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.87 127.42 33.48 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 49.0 pt -111.41 161.87 9.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.565 0.698 . . . . 0.0 112.692 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 24.0 tp -117.74 108.25 15.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.809 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 54.7 mt -96.37 116.85 29.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.832 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.493 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 13.4 ttp-105 -102.94 116.26 32.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.671 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.2 t-80 -58.44 108.32 0.61 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.505 ' OG ' HG22 ' A' ' 66' ' ' THR . 58.6 m -49.71 -53.09 26.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.434 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.3 t80 -58.57 -69.7 0.18 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -64.99 -23.75 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.27 -1.92 83.5 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.309 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.2 mtt -81.56 -164.65 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.503 0.192 . . . . 0.0 110.644 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.9 m-85 -134.77 137.87 43.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.04 129.2 29.99 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -138.26 147.6 43.85 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.7 t -94.98 96.45 9.29 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.498 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.6 mt -71.44 156.66 39.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.574 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 45.7 t -83.13 -7.31 59.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.189 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 72.5 p -88.63 121.14 30.69 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.854 0.359 . . . . 0.0 111.23 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.559 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 28.6 t -75.53 -60.31 2.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.617 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 55.55 89.89 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.126 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.6 p -162.74 -65.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.656 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.2 p -163.86 -69.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.405 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 9.1 t -87.97 -18.59 28.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.425 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 55.42 84.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.387 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -175.82 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.097 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -55.33 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.421 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -100.26 149.52 23.5 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.528 0.68 . . . . 0.0 112.158 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 18.5 m-85 -100.01 171.01 8.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.04 177.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -89.37 144.05 26.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 76.6 t -113.4 117.07 54.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.0 -147.19 5.6 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.307 -0.949 . . . . 0.0 113.006 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.7 mt -117.34 147.74 42.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.94 0.4 . . . . 0.0 111.074 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -136.05 142.95 44.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.742 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -75.4 -55.77 5.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.783 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.43 145.82 30.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 0.0 110.882 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.3 p -103.59 -8.04 20.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.994 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 69.0 p -55.09 109.95 0.6 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.408 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.65 -158.36 23.21 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.42 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -122.13 -13.39 8.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.704 0.288 . . . . 0.0 111.124 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.13 67.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.094 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.9 m -91.96 8.3 38.16 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.43 132.39 54.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.106 0.479 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.74 117.89 22.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.63 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.434 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 16.0 p -78.99 125.8 29.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.172 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.478 HD12 HG21 ' A' ' 175' ' ' VAL . 3.4 pt -87.83 136.45 23.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.851 0.357 . . . . 0.0 110.676 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.489 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 84.7 m-70 -129.04 150.21 74.71 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.644 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.0 Cg_endo -67.17 138.72 48.14 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.205 . . . . 0.0 112.287 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.23 66.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 63.1 m -112.82 -167.78 1.23 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.176 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -91.59 -13.35 32.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.903 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -63.03 -35.71 81.13 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.997 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 75.9 mmt-85 -91.31 143.87 26.19 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 56.0 m -124.82 166.4 16.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.414 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.84 131.21 45.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.545 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.41 -14.88 64.27 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.082 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -68.77 154.71 41.48 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.947 0.403 . . . . 0.0 111.043 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -70.55 142.89 51.74 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.478 HG21 HD12 ' A' ' 162' ' ' ILE . 93.3 t -93.03 110.92 23.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.498 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 153.23 40.14 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 121.289 0.566 . . . . 0.0 111.363 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 16.5 t -69.66 120.88 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 176.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.25 -13.75 30.96 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.304 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -67.58 132.28 47.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.321 . . . . 0.0 111.001 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.1 m-20 -73.1 116.17 13.3 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.421 HD21 HG13 ' A' ' 175' ' ' VAL . 60.7 mt -101.43 148.83 24.71 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.676 0.751 . . . . 0.0 112.964 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.532 HD13 ' NE2' ' A' ' 209' ' ' GLN . 51.9 mt -113.53 113.81 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 176.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -93.6 137.28 33.03 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.112 0.482 . . . . 0.0 112.224 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.438 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.5 t -130.52 125.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.793 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.6 t -63.88 125.62 24.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.853 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 98.6 t -70.14 -30.81 45.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.88 0.372 . . . . 0.0 110.711 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.2 t -81.6 -33.78 31.32 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 69.9 m -120.77 10.16 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.498 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.3 31.19 0.36 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.498 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 27.4 mtt85 -112.2 142.66 44.41 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.089 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.475 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 58.8 m-85 -73.76 152.41 40.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 36.9 tp -74.76 75.99 2.08 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.64 149.47 38.18 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -174.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.54 116.46 31.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.753 -1.567 . . . . 0.0 107.768 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 51.7 p -110.05 146.26 35.67 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -105.68 92.67 4.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.548 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -80.82 -174.84 49.03 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.435 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.1 m-80 0.66 -79.37 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.283 0.633 . . . . 0.0 112.409 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.8 p -146.61 12.2 1.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.98 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.7 p -125.94 -179.45 4.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.1 m95 -106.85 136.45 46.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.18 0.514 . . . . 0.0 111.196 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.548 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 16.8 m80 -128.66 173.01 10.68 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.009 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.02 136.43 60.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.231 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -154.0 172.24 17.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.572 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.476 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -99.15 95.2 6.93 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.095 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.72 -179.4 3.63 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.321 -177.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -88.67 8.59 27.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.178 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 47.2 mt-30 -116.02 138.19 51.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.769 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.532 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.3 mt-30 -66.62 175.63 2.26 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.319 1.057 . . . . 0.0 113.242 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.0 m -170.04 121.3 0.65 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.954 -1.93 . . . . 0.0 107.67 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 46.2 mt -74.68 131.42 40.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.798 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.3 m95 -118.89 127.48 53.53 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.344 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.5 t -93.16 101.45 13.74 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.318 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.777 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.9 t -93.86 102.5 13.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.663 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.18 142.03 27.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.335 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.28 103.93 0.39 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.14 1.893 . . . . 0.0 111.098 178.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.5 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.3 mm . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.299 -179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.793 0.33 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -121.11 154.13 36.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.7 mt -79.95 122.91 27.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -110.67 157.23 19.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.105 0.479 . . . . 0.0 111.257 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 7.4 p -67.64 157.19 35.07 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.828 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 69.16 -2.2 1.89 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.793 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -73.95 139.81 45.13 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.443 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 16.8 tt0 -84.0 118.13 23.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.463 HG11 HD11 ' A' ' 69' ' ' LEU . 17.3 m -135.52 169.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.659 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -131.96 141.0 46.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 108.388 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.76 120.82 40.66 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.571 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -122.19 148.58 44.77 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.698 0.761 . . . . 0.0 112.323 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.514 ' SG ' HD22 ' A' ' 194' ' ' LEU . 27.1 t -136.45 147.45 47.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.492 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.0 m -88.99 123.49 33.36 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.552 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.665 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.42 120.86 41.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.094 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 m -126.51 133.32 51.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.766 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.522 HG23 ' CD2' ' A' ' 29' ' ' HIS . 18.4 tt -170.4 148.59 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.499 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 28' ' ' ILE . 48.4 m-70 58.4 40.26 24.42 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.908 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.05 22.16 12.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.594 179.492 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -126.21 145.75 50.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.456 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -131.12 149.02 52.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.905 0.383 . . . . 0.0 111.196 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -161.6 169.58 21.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -116.42 138.22 51.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.526 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.6 mt -128.06 139.44 52.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.705 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 48.0 t -104.61 142.63 34.31 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.632 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.3 tp -62.27 114.85 3.71 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.751 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.67 165.04 13.22 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.5 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.56 166.27 10.1 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.715 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.59 145.75 38.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.616 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.16 17.34 33.43 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.198 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -123.44 150.27 44.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.852 0.358 . . . . 0.0 110.621 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.18 -135.8 15.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.493 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 6.4 p30 -85.12 8.7 17.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.689 0.28 . . . . 0.0 111.083 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.465 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.52 29.24 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.293 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -77.26 139.33 39.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.019 0.438 . . . . 0.0 110.546 179.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.3 m -81.12 151.18 28.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.593 0.711 . . . . 0.0 111.119 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -144.85 -165.65 2.21 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.61 178.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.8 mt -130.64 140.7 50.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.386 0.613 . . . . 0.0 112.083 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -107.2 140.91 39.33 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.59 179.54 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.481 ' HA ' HD23 ' A' ' 35' ' ' LEU . 78.9 p -81.27 138.91 35.7 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.504 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 54.6 p -102.66 169.96 8.31 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.451 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 16.0 m -56.89 -15.09 4.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 59.56 19.26 7.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.643 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.9 m -148.33 71.24 1.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.684 -0.235 . . . . 0.0 111.376 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -86.15 -27.2 24.74 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 122.91 0.484 . . . . 0.0 110.503 -0.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.504 ' C ' ' HB ' ' A' ' 52' ' ' THR . 1.5 p30 -149.77 -109.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.686 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.9 t 61.23 100.4 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.91 140.56 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 123.399 2.732 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.406 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.4 Cg_endo -50.89 -39.92 58.33 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.479 2.119 . . . . 0.0 111.307 179.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -119.35 81.71 1.76 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.602 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.631 HD11 HG11 ' A' ' 21' ' ' VAL . 45.5 tp -63.39 -30.32 71.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.408 -178.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.2 m -46.72 -55.76 7.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 26.9 pt -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.659 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.48 -3.27 43.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 0.0 111.262 -179.363 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.8 m -83.72 134.55 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.271 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.87 164.85 27.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.02 133.64 65.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.817 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD11 HG11 ' A' ' 20' ' ' VAL . 14.7 mt -82.85 65.01 7.76 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.3 mm-40 -44.55 -59.66 2.35 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.416 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.5 mm-40 -125.93 164.19 21.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.682 0.753 . . . . 0.0 112.897 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -156.18 84.77 1.0 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.993 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.0 mt -111.84 157.92 20.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.457 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -71.64 147.87 47.09 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.6 t -49.55 -44.12 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.095 0.474 . . . . 0.0 110.247 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -58.83 -50.08 75.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.98 97.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.828 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.81 -44.19 96.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.157 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.14 -33.14 73.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.884 0.373 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.13 -41.92 85.33 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.551 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.7 mtt -64.32 -44.16 92.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.04 -31.58 69.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.823 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.85 69.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.753 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -75.44 -21.3 58.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.564 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 67.4 p -83.33 -9.65 58.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.357 . . . . 0.0 111.116 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 t -76.82 -19.49 14.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.734 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -81.13 -69.82 0.58 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.005 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -162.11 -82.1 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.99 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -169.58 165.49 10.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.733 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.35 -69.07 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.757 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.29 13.88 55.31 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.692 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -117.95 25.61 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.783 0.325 . . . . 0.0 110.79 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -57.14 -60.73 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.006 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -120.46 81.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.765 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.41 -5.2 9.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.586 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.79 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 20.9 mm-40 -53.8 -41.54 67.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.816 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.759 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 32.3 mtmm -86.61 -51.11 6.35 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 120.251 1.387 . . . . 0.0 111.326 -2.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -55.87 -40.52 73.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.847 -1.524 . . . . 0.0 112.881 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 20.8 tptm -58.18 -34.42 70.33 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.206 -179.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.79 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.0 t80 -73.44 -44.73 57.53 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 15.9 tpt -57.77 -34.37 69.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.216 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.5 mtp -73.22 -49.86 25.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -59.84 -34.69 73.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.646 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.9 m -72.65 -46.86 51.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.913 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.67 71.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -87.96 -26.99 22.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.744 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.01 -33.9 56.53 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.363 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -159.42 117.42 0.77 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.448 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.428 ' HA2' ' HA ' ' A' ' 110' ' ' HIS . . . 148.2 104.42 0.34 Allowed Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.444 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.428 ' HA ' ' HA2' ' A' ' 109' ' ' GLY . 26.7 m80 -76.39 -174.33 2.82 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 117.977 0.889 . . . . 0.0 110.957 0.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.429 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 13.3 ptp180 -137.79 139.48 40.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 174' ' ' LYS . 88.8 m -70.8 148.16 48.17 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.094 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 mp -82.19 131.33 35.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.514 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 74.5 mt -116.37 141.85 47.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.387 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.36 131.86 51.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.495 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.21 -10.37 61.62 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.178 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -85.83 140.24 30.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.072 0.463 . . . . 0.0 111.365 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.88 127.53 33.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.3 pt -111.91 161.77 10.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.521 0.677 . . . . 0.0 112.732 -178.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.416 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.7 tp -117.49 109.31 16.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.885 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.404 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.2 mt -96.67 118.11 32.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.768 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.467 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.6 ttp-105 -104.28 116.46 32.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.454 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.453 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.8 t-80 -58.82 107.44 0.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.3 t -49.79 -49.95 46.63 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -177.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 51.8 t80 -61.09 -67.25 0.42 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.423 ' OG ' HD13 ' A' ' 149' ' ' LEU . 56.0 p -68.22 -20.38 64.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.396 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.97 -0.85 71.02 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.252 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -82.67 -164.62 0.88 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.8 m-85 -133.95 138.26 45.36 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.6 tp -54.05 127.89 28.36 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 177.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.8 t -136.69 149.86 48.14 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -97.52 99.09 10.48 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.536 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 11.8 mt -75.9 153.5 36.66 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 54.4 m -84.01 9.95 11.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.954 -178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.2 p -94.03 124.81 38.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.0 p -61.87 -60.29 3.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -170.78 -76.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.9 p -172.78 -13.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.1 m -125.96 -173.2 2.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 62.8 m -58.95 104.68 0.25 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -164.4 157.72 17.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.984 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -154.47 -9.68 0.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.808 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.47 -81.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.357 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -94.96 149.94 20.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.386 0.612 . . . . 0.0 112.071 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.536 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.0 m-85 -100.17 170.38 8.5 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.276 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -89.26 144.3 26.2 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -113.63 117.6 55.9 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.348 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.5 -147.08 5.52 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.899 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 59.0 mt -117.42 151.28 37.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.893 0.378 . . . . 0.0 110.774 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -141.69 142.97 33.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.886 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.54 -64.11 1.1 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.566 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -73.46 145.11 45.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.664 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 60.2 p -104.05 -5.13 22.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.947 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.3 p -54.71 111.84 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.527 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.84 -160.56 22.84 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.485 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.432 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -118.53 -12.29 9.81 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.803 0.335 . . . . 0.0 111.234 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.49 66.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 77.9 m -94.55 10.86 33.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -111.8 131.64 55.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.57 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.0 m95 -127.22 116.64 20.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.662 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 8.0 p -79.25 128.6 33.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.188 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.492 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.81 135.59 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 0.0 110.842 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 66.9 m-70 -127.8 150.23 72.74 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.186 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.715 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.91 137.08 43.72 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.504 2.136 . . . . 0.0 112.297 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.01 -45.79 59.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.752 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.432 ' HB2' ' NE2' ' A' ' 168' ' ' GLN . 85.3 p -108.53 -175.59 2.82 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.262 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.74 14.83 14.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.139 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.432 ' NE2' ' HB2' ' A' ' 166' ' ' SER . 2.6 mp0 -88.21 -33.06 18.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.715 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.4 mmp_? -92.46 146.76 23.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.069 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 32.0 t -125.1 165.76 17.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.278 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.8 OUTLIER -65.83 131.63 46.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.488 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 172' ' ' GLY . . . . . 0.402 ' O ' HD22 ' A' ' 114' ' ' LEU . . . 93.95 -16.43 60.91 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.049 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.1 mt-10 -67.49 155.08 39.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.042 0.448 . . . . 0.0 111.205 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 112' ' ' THR . 73.8 mttt -71.16 142.68 50.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.602 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.492 HG21 HD12 ' A' ' 162' ' ' ILE . 95.4 t -93.74 112.0 25.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.148 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.441 ' HD2' ' N ' ' A' ' 176' ' ' ARG . 1.2 mpt_? -78.58 154.83 30.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-O 121.388 0.614 . . . . 0.0 111.611 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 55.2 t -69.05 122.72 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.25 -12.69 36.93 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.076 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.26 126.29 29.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.787 0.327 . . . . 0.0 110.796 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.449 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 18.9 m-20 -69.49 114.77 8.03 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.476 HD21 HG13 ' A' ' 175' ' ' VAL . 60.4 mt -100.44 151.84 21.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.788 0.804 . . . . 0.0 112.998 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.484 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.2 mt -115.75 113.74 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 9.8 mp -93.48 135.32 34.84 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.201 0.525 . . . . 0.0 112.189 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.1 t -127.35 126.66 68.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.739 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.4 t -67.03 124.18 22.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.432 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 98.4 t -68.64 -32.72 56.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.946 0.403 . . . . 0.0 110.968 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.2 t -78.0 -37.62 46.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 p -117.63 7.76 12.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 46.34 31.95 1.4 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.49 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 36.1 mtt85 -112.42 142.3 45.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.842 0.353 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 63.6 m-85 -74.31 154.04 39.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.4 tp -76.09 76.95 2.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.404 -2.072 . . . . 0.0 105.404 175.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.403 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.3 t60 -76.89 150.23 36.03 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.514 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.4 tp -99.84 115.88 30.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 113.763 -1.562 . . . . 0.0 107.656 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 68.3 m -109.65 145.66 36.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -103.4 96.98 7.11 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 177.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.744 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -76.73 -167.03 25.67 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.04 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.461 ' C ' ' O ' ' A' ' 197' ' ' GLY . 3.3 p30 -18.92 -63.03 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.3 p -154.7 11.59 0.37 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.217 0.532 . . . . 0.0 109.612 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.1 t -127.04 179.02 5.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.832 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.665 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.5 m95 -106.24 135.76 47.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.297 0.57 . . . . 0.0 111.27 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.744 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 9.6 m80 -128.45 174.02 9.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.863 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -128.14 132.43 68.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.308 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -149.82 168.0 24.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.662 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.498 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.7 96.79 9.63 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.75 179.45 3.95 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.386 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -87.2 8.41 24.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.186 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.403 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 16.5 mm-40 -117.23 136.68 52.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.724 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.484 ' NE2' HD13 ' A' ' 182' ' ' ILE . 88.7 mt-30 -65.23 174.7 1.94 Allowed 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 122.364 1.078 . . . . 0.0 113.007 -178.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.7 m -166.71 121.54 1.11 Allowed 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.99 -1.914 . . . . 0.0 107.798 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 51.2 mt -75.23 128.74 36.14 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.035 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.2 m95 -116.27 145.32 43.24 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.611 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 39.2 t -113.04 101.29 9.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.278 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 92.5 t -92.61 102.19 13.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.918 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.36 27.89 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.475 ' O ' HG12 ' A' ' 217' ' ' ILE . 22.8 Cg_exo -64.8 105.26 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.252 1.968 . . . . 0.0 111.484 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.49 HG23 HD21 ' A' ' 62' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.833 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.829 0.347 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -122.7 153.05 39.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.653 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.4 mt -78.55 124.35 28.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -112.1 157.47 20.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.07 0.462 . . . . 0.0 110.952 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.2 p -67.64 155.38 39.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.863 179.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 71.02 -3.36 2.05 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.874 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -72.58 134.7 45.32 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.51 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -80.58 119.39 23.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.574 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.6 m -136.18 171.14 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.625 0.726 . . . . 0.0 112.948 -177.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.691 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.8 m -133.73 137.15 53.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.271 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.767 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.1 mp -97.73 121.77 40.04 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.613 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.46 ' HB2' ' OG ' ' A' ' 213' ' ' SER . 24.4 mt-30 -121.34 156.0 33.54 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.352 0.596 . . . . 0.0 111.538 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.529 ' SG ' HD22 ' A' ' 194' ' ' LEU . 21.5 t -143.7 144.48 31.88 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.368 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -86.14 124.98 33.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.445 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.36 119.53 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.034 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.2 m -122.46 139.38 53.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.781 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.2 tt -178.38 144.55 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.671 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.1 m80 59.11 41.15 21.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.318 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.3 20.98 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.626 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -127.81 134.28 49.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 110.672 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -124.02 146.22 48.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.056 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -156.21 171.62 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.857 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -117.87 136.37 53.5 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.464 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.07 143.02 51.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.44 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.612 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 50.9 t -107.64 142.67 37.24 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.649 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.3 tp -62.35 114.51 3.53 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.72 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.422 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -114.48 164.28 14.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.434 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 166.79 10.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.686 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.23 151.26 47.5 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.687 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.12 -6.92 87.66 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.624 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -107.82 163.07 13.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.11 -142.03 25.82 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.401 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.2 p30 -84.09 9.68 11.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 110.622 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.61 29.28 0.4 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.949 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.4 mt -79.37 139.17 37.82 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.97 0.414 . . . . 0.0 110.621 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.6 m -80.25 149.84 30.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.545 0.688 . . . . 0.0 111.131 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -144.17 -166.97 2.49 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.591 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.4 mt -129.79 141.43 50.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.336 0.588 . . . . 0.0 112.266 -178.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 mt-10 -107.88 139.06 43.05 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.755 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.477 ' HA ' HD23 ' A' ' 35' ' ' LEU . 50.1 m -80.68 140.23 35.74 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.457 HG21 ' OE1' ' A' ' 23' ' ' GLN . 51.8 p -103.69 160.99 14.29 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.585 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 10.9 t -49.24 -29.13 5.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.93 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.7 t30 62.96 0.23 0.68 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.564 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.455 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 74.5 p -143.91 62.12 1.36 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.09 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HA ' ' N ' ' A' ' 55' ' ' SER . 94.1 mttt -114.44 133.45 55.73 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.292 0.637 . . . . 0.0 110.708 -0.067 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.52 ' O ' ' HB3' ' A' ' 53' ' ' SER . 6.0 p30 41.86 -132.27 0.44 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.387 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 56' ' ' LYS . 60.0 t 61.75 102.34 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.402 ' HG3' HG22 ' A' ' 52' ' ' THR . 5.6 Cg_exo -75.92 139.78 22.34 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 123.231 2.621 . . . . 0.0 111.556 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -51.05 -37.94 58.42 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.388 2.059 . . . . 0.0 111.541 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -121.26 81.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.589 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.534 HD11 HG11 ' A' ' 21' ' ' VAL . 44.6 tp -62.9 -30.93 71.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.492 -178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.9 m -47.62 -54.88 10.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.422 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.0 pt -68.54 -16.9 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.691 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.01 -0.39 47.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.075 0.464 . . . . 0.0 111.305 -179.183 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.3 m -85.27 134.12 34.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.349 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -138.27 162.5 34.18 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.101 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.581 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.8 134.57 65.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.71 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 121' ' ' LEU . 16.4 mt -83.25 64.93 8.01 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.51 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.8 mm-40 -44.25 -62.9 1.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.408 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 56.7 mm-40 -122.91 163.08 21.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.705 0.764 . . . . 0.0 112.897 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -155.34 85.08 1.06 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.478 -1.237 . . . . 0.0 108.951 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.33 158.14 20.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.8 p -71.13 146.83 48.95 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -49.92 -45.72 22.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.083 0.468 . . . . 0.0 110.195 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.2 ttp85 -55.44 -54.24 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.454 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.97 -45.31 95.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.821 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.4 tp -59.06 -44.55 91.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.281 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.95 -34.82 77.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -66.12 -41.07 91.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.738 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.406 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.2 mtt -64.62 -44.92 89.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.5 mt -67.66 -34.82 77.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.08 -33.3 74.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -72.92 -18.76 61.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.559 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 80.9 p -91.22 -4.37 56.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.602 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -77.34 -26.72 15.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.36 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -104.9 147.99 27.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.858 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 88' ' ' LYS . 3.2 mptp? -82.16 99.85 9.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 59.1 p -141.01 -63.77 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.698 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 55.44 -164.28 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.142 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 108.97 -10.91 34.43 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.587 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -83.89 89.12 7.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.855 0.359 . . . . 0.0 110.791 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.7 m -141.23 -175.45 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.999 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' A' ' 97' ' ' LYS . 5.4 p-10 -82.61 77.54 9.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.508 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 19.4 m -83.42 1.65 3.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.701 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.809 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 3.2 mm-40 -54.01 -37.91 64.55 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.789 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.809 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 54.0 pttt -87.5 -50.98 6.18 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 120.372 1.442 . . . . 0.0 111.691 -3.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.413 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.7 p-90 -63.99 -28.8 70.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.948 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -61.8 -41.66 98.02 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.776 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.769 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.3 t80 -74.18 -45.17 50.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.123 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.4 ttp -56.57 -42.86 79.32 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.653 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.2 mmt -73.55 -40.07 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.163 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.51 -45.8 84.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.891 0.377 . . . . 0.0 110.626 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 52.4 p -70.09 -47.05 63.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.893 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.53 66.57 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.09 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -88.05 -35.66 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.84 -66.85 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.345 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 56.83 -97.12 0.06 OUTLIER Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.732 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 110' ' ' HIS . . . -137.42 -164.21 9.97 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.424 ' HA ' ' HA3' ' A' ' 109' ' ' GLY . 17.6 m80 -108.32 -164.05 0.93 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 117.953 0.877 . . . . 0.0 110.609 0.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -152.55 142.13 21.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.01 0.433 . . . . 0.0 111.115 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.471 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 63.1 m -71.64 147.23 47.72 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.255 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.63 131.39 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.424 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.5 mt -115.58 141.58 47.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.291 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -61.98 129.58 41.58 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.983 0.42 . . . . 0.0 110.491 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.78 -13.14 57.88 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.051 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.49 140.89 33.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.04 0.448 . . . . 0.0 111.324 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.12 126.25 31.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.6 pt -112.06 158.26 12.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.527 0.679 . . . . 0.0 112.77 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 153' ' ' THR . 20.6 tp -114.26 109.97 19.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.966 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -97.0 116.48 29.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.688 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.581 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.9 ttp85 -102.85 117.11 33.91 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.795 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.1 t-80 -59.72 108.58 0.76 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.0 t -53.02 -45.31 67.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 53.7 t80 -65.16 -57.56 8.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.21 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.445 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.8 p -79.82 -15.39 57.51 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.63 -0.49 56.03 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.432 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.6 mtt -83.23 -165.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.466 0.175 . . . . 0.0 110.566 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 70.4 m-85 -134.09 138.11 45.06 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.472 HD13 HD21 ' A' ' 37' ' ' LEU . 23.0 tp -54.97 125.62 21.11 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -134.37 146.92 50.36 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 49.7 t -93.6 97.18 10.32 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -73.66 153.26 40.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.467 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.0 t -83.6 2.88 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.814 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 50.2 p -89.79 122.49 32.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.771 0.319 . . . . 0.0 110.909 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.4 ' HB3' ' H ' ' A' ' 142' ' ' LYS . 57.5 m -62.73 -58.86 5.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.747 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -140.52 -70.99 0.37 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.7 t -158.44 -51.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.986 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.4 m -123.17 -36.63 2.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.073 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.0 t -87.25 163.58 16.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.094 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -124.41 102.03 7.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.974 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.4 ' H ' ' HB3' ' A' ' 136' ' ' SER . 36.9 mtmm -111.56 -167.88 1.24 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.433 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 3.5 mm? -57.82 -85.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.271 0.558 . . . . 0.0 111.143 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -49.93 148.23 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.206 -178.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.7 m-85 -104.45 177.06 4.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.425 -1.261 . . . . 0.0 108.692 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -94.18 141.62 28.34 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 65.4 t -112.43 116.98 54.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.32 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.39 -147.9 5.8 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.758 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.445 HD13 ' OG ' ' A' ' 126' ' ' SER . 68.1 mt -116.74 151.89 35.46 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.87 0.366 . . . . 0.0 110.58 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -141.23 136.08 31.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.805 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -69.45 -46.84 65.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.15 147.75 25.48 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.754 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.43 HG21 HD21 ' A' ' 120' ' ' LEU . 82.4 p -107.03 -7.6 16.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.62 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.6 p -53.87 116.78 2.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.502 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.21 -161.52 19.69 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.686 -0.769 . . . . 0.0 111.495 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.464 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.3 mt-10 -118.34 -15.19 9.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.741 0.305 . . . . 0.0 111.271 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.3 -32.17 68.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.126 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.3 m -88.15 4.5 45.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.478 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -109.8 135.35 50.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.044 0.449 . . . . 0.0 111.207 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.0 m95 -128.74 116.57 19.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.604 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.8 p -78.59 124.6 28.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.475 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.16 136.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.828 0.347 . . . . 0.0 110.936 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.45 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 77.9 m-70 -128.06 150.03 72.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.618 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.8 Cg_endo -66.26 138.22 50.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.497 2.131 . . . . 0.0 112.483 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.18 -43.39 52.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.581 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 50.4 m -105.1 -170.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.286 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -92.44 -12.53 31.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -67.38 -35.48 79.41 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.318 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.2 mmt-85 -87.47 146.04 26.01 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.3 t -128.68 168.22 16.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.899 0.38 . . . . 0.0 111.411 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.71 132.28 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.151 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.56 -14.63 64.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.947 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -70.75 155.7 40.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.011 0.434 . . . . 0.0 111.258 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -71.53 144.13 49.71 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.48 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.481 HG13 HD21 ' A' ' 181' ' ' LEU . 80.0 t -94.84 111.14 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.409 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.89 154.54 35.95 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.399 0.618 . . . . 0.0 111.572 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.48 123.0 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.326 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -18.21 30.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -63.95 130.3 43.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.721 0.296 . . . . 0.0 110.739 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.619 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -72.34 115.31 11.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.481 HD21 HG13 ' A' ' 175' ' ' VAL . 66.8 mt -99.5 147.37 25.37 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.745 0.783 . . . . 0.0 112.911 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.45 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 58.4 mt -112.81 112.29 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.6 mp -92.49 136.67 33.01 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.943 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.466 HG22 ' CD1' ' A' ' 191' ' ' TYR . 83.4 t -130.46 125.51 59.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.793 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.9 m -61.2 129.0 39.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.464 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.3 t -72.54 -32.48 41.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.548 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 42.4 t -79.93 -37.28 34.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.526 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 50.5 m -114.07 0.5 14.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.18 27.59 3.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 179.466 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.433 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 1.9 mtt-85 -108.14 142.41 38.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.03 0.443 . . . . 0.0 111.124 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.2 m-85 -72.95 153.14 41.09 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.0 tp -75.76 74.86 2.73 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -74.2 150.17 40.5 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -174.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 194' ' ' LEU . . . . . 0.529 HD22 ' SG ' ' A' ' 24' ' ' CYS . 12.5 tp -99.82 116.22 31.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.522 176.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.412 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 45.3 t -110.05 147.8 32.9 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -177.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -107.64 89.76 3.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.559 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.75 -174.94 45.43 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.361 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 22.6 m-80 1.75 -79.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.435 0.694 . . . . 0.0 112.401 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 38.8 t -146.95 11.56 1.07 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.0 t -125.45 -179.17 4.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.752 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.24 136.08 47.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.27 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.559 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 17.3 m80 -127.9 173.29 10.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.007 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.8 p -127.75 131.63 69.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.103 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.2 173.45 12.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.809 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.04 91.36 4.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.165 178.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -109.89 -179.82 3.91 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -88.18 7.7 30.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.214 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -116.51 137.33 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.608 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -64.73 175.44 1.46 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.399 1.095 . . . . 0.0 113.287 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -169.71 120.78 0.68 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.895 -1.957 . . . . 0.0 107.842 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.619 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 42.0 mt -74.47 132.8 42.21 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.937 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.414 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.9 m95 -121.31 118.24 29.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.489 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 23' ' ' GLN . 33.7 p -85.4 101.44 12.6 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.059 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.767 HG22 ' HG ' ' A' ' 22' ' ' LEU . 84.6 t -92.78 104.81 16.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.86 139.42 23.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.249 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 217' ' ' ILE . 33.1 Cg_exo -62.16 105.81 0.42 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.09 1.86 . . . . 0.0 111.266 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.574 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.156 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.778 0.323 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -120.56 151.09 39.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.46 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.3 mt -76.64 128.32 34.48 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 9.7 mmt85 -116.53 157.78 24.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.328 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -68.29 155.51 39.59 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.748 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.93 -8.26 1.31 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.441 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.0 m-20 -69.15 143.02 54.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 15.3 tt0 -89.57 116.29 27.61 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.537 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -132.54 175.65 10.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.687 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -135.15 142.03 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.575 176.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.772 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -103.53 117.91 35.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 39.3 mt-30 -118.97 149.94 40.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.674 0.75 . . . . 0.0 112.458 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.1 p -137.26 142.59 41.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.558 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.9 m -84.85 121.97 28.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.475 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.63 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -112.77 120.07 40.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.095 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 m -125.46 134.16 52.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.539 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -170.77 145.43 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.486 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.5 m80 58.26 39.12 25.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.793 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 61.45 25.61 15.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.258 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -127.33 133.47 50.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.282 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -122.64 148.71 44.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.474 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -161.85 173.1 15.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.553 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -120.53 136.54 54.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.569 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -125.78 141.03 52.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.533 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.645 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 51.4 t -104.75 146.23 29.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.491 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.502 HD21 HD13 ' A' ' 130' ' ' LEU . 31.9 tp -65.34 112.6 3.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.943 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.51 163.8 13.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.571 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.4 164.92 10.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.703 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.07 143.53 42.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.69 179.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.22 18.73 21.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.277 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -124.72 147.55 48.56 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.42 -138.75 20.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.485 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -80.51 7.56 9.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.734 0.302 . . . . 0.0 110.787 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.447 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.77 32.44 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.095 179.619 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -78.08 137.61 38.32 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 110.449 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -78.85 150.81 32.15 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.583 0.706 . . . . 0.0 111.449 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 p90 -145.21 -166.28 2.38 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.488 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.8 mt -129.09 142.51 50.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.403 0.62 . . . . 0.0 112.096 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 tt0 -110.64 138.47 46.99 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.797 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.459 ' O ' ' HD2' ' A' ' 60' ' ' PRO . 49.3 m -76.66 146.08 38.36 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 76.7 p -104.59 120.86 42.27 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.995 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.486 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 19.2 t 17.02 54.7 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 O-C-N 124.306 1.004 . . . . 0.0 112.789 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 51.14 -88.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.336 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.417 ' N ' ' O ' ' A' ' 53' ' ' SER . 72.3 p -116.68 99.28 7.02 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.931 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -153.61 13.99 0.48 Allowed 'General case' 0 C--N 1.344 0.331 0 C-N-CA 123.205 0.602 . . . . 0.0 110.712 0.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.486 ' O ' ' HB3' ' A' ' 53' ' ' SER . 21.9 p-10 -132.13 176.99 7.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 42.0 t 61.3 104.1 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.529 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 2.8 Cg_exo -76.72 139.5 20.04 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 123.211 2.607 . . . . 0.0 111.5 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.459 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.4 Cg_endo -51.36 -39.22 63.59 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.383 2.055 . . . . 0.0 111.315 179.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -121.71 84.34 2.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.686 179.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 HG11 ' A' ' 21' ' ' VAL . 46.1 tp -64.91 -30.73 71.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.17 -178.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.1 m -46.69 -54.0 10.53 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.464 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.9 pt -69.01 -18.71 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.687 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.87 -2.21 47.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.068 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.411 HG23 ' HG2' ' A' ' 19' ' ' GLU . 30.4 m -84.7 133.01 34.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.387 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.88 162.69 33.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.556 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -126.42 133.64 68.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.786 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 18' ' ' ASP . 15.0 mt -82.69 65.4 7.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.509 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.8 mm-40 -45.01 -61.22 1.71 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 59.8 mm-40 -124.57 164.66 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.651 0.739 . . . . 0.0 112.796 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 57.1 m -157.47 86.73 0.94 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.03 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.17 154.84 28.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.271 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.7 t -68.55 150.49 47.97 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -51.82 -43.51 34.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.078 0.466 . . . . 0.0 110.162 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HB3' ' NH1' ' A' ' 76' ' ' ARG . 18.4 ttp-105 -56.58 -57.13 13.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.912 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.61 89.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.091 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.6 tp -61.83 -46.49 89.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.256 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -66.63 -33.0 74.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.958 0.409 . . . . 0.0 110.488 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -66.66 -42.84 85.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.681 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -64.44 -42.42 95.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.757 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.402 ' O ' HG23 ' A' ' 86' ' ' VAL . 87.3 mt -69.17 -33.39 73.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.75 -31.81 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.6 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -71.27 -24.08 62.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.46 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.6 p -82.54 -7.19 59.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.845 0.355 . . . . 0.0 111.32 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 82' ' ' LEU . 21.6 t -88.88 -24.98 5.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.975 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.69 -68.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.171 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -149.41 -61.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.808 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.4 p -60.59 132.28 53.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.735 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -155.43 122.1 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.792 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 99.12 15.45 33.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 -143.4 151.17 40.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.742 0.306 . . . . 0.0 110.774 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.87 -34.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -76.11 85.37 2.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.832 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.7 m -86.04 -5.25 9.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.772 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.823 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.0 mm-40 -53.8 -41.69 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 118.666 -0.683 . . . . 0.0 112.635 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.738 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 27.3 tttm -86.32 -50.86 6.62 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 125.469 1.508 . . . . 0.0 111.641 -2.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -57.53 -35.52 70.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.041 -1.436 . . . . 0.0 113.264 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.653 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 12.8 mmmm -64.18 -33.77 76.56 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.45 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.823 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 7.7 t80 -74.17 -49.43 23.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.224 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 50.0 ttm -59.45 -44.32 92.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.219 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.4 ttt -70.15 -49.25 52.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.534 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.8 -38.4 75.45 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.047 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 -46.77 57.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.83 -54.35 48.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.572 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -70.92 -34.06 71.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.087 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.82 3.08 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.373 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 60.06 46.2 94.6 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.687 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 132.31 175.94 14.2 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.674 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -151.73 166.96 29.72 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.381 0.59 . . . . 0.0 110.833 0.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -159.89 150.72 19.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.019 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 84.4 m -78.98 144.28 34.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.411 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.09 130.39 35.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.4 mt -115.15 142.36 46.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.332 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.11 130.74 46.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.044 0.45 . . . . 0.0 110.529 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.6 -13.04 59.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.069 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -83.05 140.02 32.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.022 0.439 . . . . 0.0 111.456 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.99 128.18 33.82 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.5 pt -112.65 159.72 12.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.649 0.738 . . . . 0.0 112.935 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.4 tp -115.66 107.19 14.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.686 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.406 ' CD2' HD23 ' A' ' 69' ' ' LEU . 47.1 mt -95.37 117.62 30.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.74 -178.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 68' ' ' VAL . 62.3 ttp85 -104.04 116.04 31.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.696 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.6 t-80 -57.69 110.71 0.94 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.9 t -52.76 -52.46 56.42 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 48.6 t80 -57.73 -66.9 0.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.0 p -66.72 -33.06 74.81 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.02 -3.11 80.44 Favored Glycine 0 C--N 1.322 -0.204 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.676 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.3 mtt -81.94 -165.5 1.0 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.716 -0.242 . . . . 0.0 110.434 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.496 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.7 m-85 -133.46 139.25 46.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.502 HD13 HD21 ' A' ' 37' ' ' LEU . 26.0 tp -54.66 127.14 26.77 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.8 t -136.5 143.99 44.07 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -91.82 97.83 11.23 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.511 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.5 mt -73.76 145.31 45.18 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.522 -178.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.5 p -76.71 -0.04 22.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.757 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.6 p -91.25 120.44 32.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 110.94 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 49.4 m -63.05 -56.61 15.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -152.47 -23.49 0.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.795 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.8 p -147.77 -64.02 0.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.036 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.7 p -165.1 -7.43 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.8 t -92.42 164.86 13.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -91.66 131.53 36.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.73 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 136' ' ' SER . 35.1 mmtp -140.63 -170.94 3.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.927 0.394 . . . . 0.0 111.343 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.52 -61.46 2.61 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.396 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -104.7 157.21 17.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.139 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 14.5 m-85 -103.85 172.72 6.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.995 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.26 144.63 25.67 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 120.995 0.426 . . . . 0.0 109.867 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 74.8 t -114.13 117.9 56.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.288 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.84 -150.44 5.81 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.008 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.447 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 65.7 mt -114.89 151.96 33.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.925 0.393 . . . . 0.0 110.776 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -140.14 142.76 35.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.859 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.61 -51.62 11.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.529 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -83.27 146.25 28.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.0 p -106.54 -7.72 17.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 65.8 p -54.73 114.07 1.56 Allowed 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.49 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.06 -160.06 21.84 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.706 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.427 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.6 mt-10 -118.85 -14.85 9.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.745 0.307 . . . . 0.0 111.429 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.3 -34.35 66.41 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.4 m -89.51 8.01 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -111.02 133.51 53.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.104 0.478 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.3 m95 -128.13 115.98 19.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.741 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 13.5 p -78.35 126.36 30.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.208 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.38 136.18 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.421 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 86.5 m-70 -129.25 151.47 77.84 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.187 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.67 140.16 55.47 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.593 2.195 . . . . 0.0 112.397 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.73 51.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.746 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 7.7 t -110.79 -168.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.441 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -95.57 4.75 52.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.333 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -84.04 -30.65 25.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.905 0.383 . . . . 0.0 111.004 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.0 mmt-85 -92.27 144.23 25.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.7 m -124.94 164.79 19.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.935 0.397 . . . . 0.0 111.64 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.465 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.69 130.64 43.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.317 179.427 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.7 -16.95 60.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.027 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -67.79 156.18 37.62 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.952 0.406 . . . . 0.0 111.093 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -72.23 144.67 48.37 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.507 HG13 HD21 ' A' ' 181' ' ' LEU . 95.5 t -94.68 113.23 28.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -77.0 155.0 32.91 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.649 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 216' ' ' PRO . 22.8 t -69.93 119.91 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 176.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.94 -13.76 31.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.309 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -66.38 132.48 48.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.813 0.339 . . . . 0.0 110.932 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.511 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.2 m-20 -73.49 110.46 7.8 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.747 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.507 HD21 HG13 ' A' ' 175' ' ' VAL . 56.6 mt -97.34 150.64 20.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.748 0.785 . . . . 0.0 112.985 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.501 HD13 ' NE2' ' A' ' 209' ' ' GLN . 48.0 mt -115.61 113.07 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 176.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.64 136.37 33.28 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.028 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.469 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.1 t -128.47 127.61 67.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.812 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 6.6 m -65.3 125.08 23.95 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.427 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.1 t -69.54 -30.36 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.963 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 94.1 p -79.94 -37.0 35.42 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.403 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 73.9 p -120.2 9.31 11.06 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 46.26 31.96 1.37 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.386 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 24.2 mtt180 -111.05 140.42 45.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.085 0.469 . . . . 0.0 110.983 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.5 m-85 -72.84 153.61 40.98 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.6 tp -75.57 75.93 2.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 175.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.26 151.07 38.41 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 115.68 1.734 . . . . 0.0 115.68 -174.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.2 tp -100.42 117.45 34.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.585 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 34.1 t -112.03 146.03 38.63 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -105.32 92.67 4.3 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.609 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.2 -173.85 44.76 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.375 -0.916 . . . . 0.0 111.419 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.531 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.1 m120 -3.28 -76.3 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.362 0.665 . . . . 0.0 112.51 -179.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 78.2 p -147.7 13.72 1.05 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.116 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.1 t -128.42 179.45 5.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.63 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.9 m95 -106.07 136.45 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.219 0.533 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.609 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 14.8 m80 -128.19 173.11 10.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.029 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.7 p -127.57 131.06 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.146 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -147.52 173.11 12.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.683 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.22 93.91 5.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.152 178.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.98 176.86 4.84 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.304 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -85.69 10.11 14.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.072 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -118.09 134.59 54.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.501 ' NE2' HD13 ' A' ' 182' ' ' ILE . 95.4 mt-30 -63.62 174.7 1.27 Allowed 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 122.389 1.09 . . . . 0.0 113.133 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.4 m -167.52 120.82 0.94 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.939 -1.937 . . . . 0.0 107.734 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.511 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.6 mt -74.53 128.76 36.34 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.004 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -115.78 147.31 41.1 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.498 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.3 t -113.62 98.57 7.14 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.326 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.1 t -91.63 100.45 11.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -117.6 135.79 23.39 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.481 ' HA ' HG12 ' A' ' 20' ' ' VAL . 17.5 Cg_endo -60.07 107.14 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 121.835 1.69 . . . . 0.0 111.135 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.537 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.6 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.121 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.829 0.347 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -122.0 153.89 37.96 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.097 179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 25.4 mt -80.53 121.94 26.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -110.96 157.89 19.39 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.09 0.472 . . . . 0.0 111.287 -179.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 p -67.62 156.2 37.38 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.661 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 71.58 -4.25 1.93 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.818 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 2.9 m-20 -73.15 133.01 43.94 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.691 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.84 121.36 25.86 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.7 m -136.93 173.93 12.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -135.62 136.76 50.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.251 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -97.49 122.92 41.1 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.672 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 38.6 mt-30 -122.84 149.29 44.37 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 112.029 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -136.18 144.07 44.76 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.627 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.4 m -86.72 122.06 30.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.04 120.51 41.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.065 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.8 m -124.15 132.29 53.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.039 0.447 . . . . 0.0 111.761 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.1 tt -169.3 146.0 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.507 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 m80 59.79 39.66 20.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.7 mppt? 61.3 21.52 12.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.372 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -124.94 144.66 50.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -131.5 146.33 52.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.978 0.418 . . . . 0.0 111.384 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -157.38 170.25 22.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.604 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -118.42 137.25 53.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.569 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -125.71 143.68 50.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.601 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.4 p -107.94 139.72 42.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 0.0 110.435 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.4 tp -60.23 109.81 1.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.008 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.498 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.06 164.34 12.51 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.6 -179.219 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.16 162.03 10.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.766 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.95 142.83 44.63 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.557 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.22 23.17 8.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.366 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -130.57 147.12 52.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.872 0.367 . . . . 0.0 110.561 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.57 -125.34 6.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.519 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.422 ' HA ' HD22 ' A' ' 44' ' ' ASN . 1.5 t-20 -93.56 8.02 42.35 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.749 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.16 31.88 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.296 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 46' ' ' LEU . 17.5 mt -80.41 134.39 36.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.602 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.53 149.72 38.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.65 0.738 . . . . 0.0 111.163 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -146.07 -166.09 2.37 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.265 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 37' ' ' LEU . 24.7 mt -128.94 145.19 51.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.386 0.613 . . . . 0.0 111.736 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 tt0 -113.23 136.61 52.55 Favored 'General case' 0 CA--C 1.5 -0.951 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.767 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.484 ' O ' ' HD2' ' A' ' 60' ' ' PRO . 43.9 t -75.88 145.12 40.77 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.565 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 78.0 p -104.15 125.12 50.2 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.683 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 52' ' ' THR . 27.7 p 18.81 55.17 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.209 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.7 t30 59.88 -81.01 0.02 OUTLIER 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.713 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.457 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 67.5 m -157.17 103.82 2.03 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.978 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.673 ' HZ2' ' HB2' ' A' ' 56' ' ' LYS . 9.7 mtmp? -143.38 -173.31 3.9 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 123.623 0.769 . . . . 0.0 110.548 -0.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.492 ' C ' ' HB ' ' A' ' 52' ' ' THR . 14.4 m120 63.48 162.63 0.11 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.344 0.592 . . . . 0.0 112.258 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.6 t 60.51 99.47 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.565 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 6.3 Cg_exo -79.85 139.95 14.2 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 123.352 2.702 . . . . 0.0 111.326 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' O ' ' A' ' 51' ' ' SER . 8.8 Cg_endo -51.44 -39.7 63.77 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.358 2.038 . . . . 0.0 111.399 179.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.404 ' O ' HG12 ' A' ' 64' ' ' ILE . 13.2 t70 -122.84 84.98 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.777 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.642 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp -67.02 -27.46 67.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.283 -178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.4 m -49.73 -51.76 36.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.498 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.8 pt -67.38 -18.4 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -178.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 58.4 m -100.63 14.15 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.652 0.263 . . . . 0.0 111.334 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -91.86 129.82 37.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -136.93 158.7 43.85 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.138 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 t -122.8 132.7 70.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.694 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.73 67.59 6.66 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 178.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 12.1 mm-40 -46.81 -63.99 0.88 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.426 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 57.3 mm-40 -123.01 162.08 23.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.712 0.768 . . . . 0.0 112.922 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.5 p -153.59 86.2 1.2 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.919 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.414 HD13 ' SD ' ' A' ' 81' ' ' MET . 7.2 mt -115.8 157.03 25.0 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.661 -178.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.2 t -70.02 150.74 46.32 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.8 t -52.84 -42.87 44.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.899 0.38 . . . . 0.0 110.323 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.1 ttp-105 -58.92 -56.87 16.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.87 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.53 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.81 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.4 -44.63 94.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.119 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -68.3 -33.86 75.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 0.0 110.52 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.46 -40.83 89.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.561 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.454 ' O ' HG23 ' A' ' 85' ' ' THR . 66.8 mtt -65.72 -45.35 83.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.738 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 64.4 mt -65.0 -36.56 84.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.615 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.48 -35.57 79.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.193 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -76.45 -20.76 56.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.383 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 81' ' ' MET . 56.0 p -85.85 0.69 52.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.925 0.393 . . . . 0.0 111.297 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.99 -31.74 15.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.825 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.78 168.3 11.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.625 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -66.88 110.35 3.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.024 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.9 p -121.35 173.99 7.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.849 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -82.42 -75.23 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.31 36.39 89.35 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.512 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -75.54 164.45 26.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.695 0.284 . . . . 0.0 110.662 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 23.0 m -74.65 -174.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.94 0.4 . . . . 0.0 111.636 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.562 ' HB2' ' HB3' ' A' ' 100' ' ' PHE . 1.8 p-10 -56.29 107.65 0.39 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.153 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.6 m -83.88 -1.97 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.229 -0.441 . . . . 0.0 112.175 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.78 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.2 OUTLIER -53.77 -41.5 67.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.454 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.78 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 9.4 mtmp? -88.63 -51.82 5.48 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 125.008 1.323 . . . . 0.0 111.038 -3.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -64.85 -28.57 69.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.676 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 41.4 ttmt -61.15 -41.66 97.15 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.634 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.615 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 53.3 t80 -73.84 -45.67 49.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.958 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.3 ttt -56.63 -39.03 72.94 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.759 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 mmt -74.06 -45.65 48.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.138 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.44 -40.99 79.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.755 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.2 p -72.93 -45.65 56.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.299 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.42 -46.46 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.274 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -82.83 -29.19 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.665 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.16 -16.43 79.67 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -50.08 130.86 28.62 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.603 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.654 ' H ' ' HB2' ' A' ' 110' ' ' HIS . . . -149.82 -65.94 0.01 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.788 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.654 ' HB2' ' H ' ' A' ' 109' ' ' GLY . 56.5 t-80 -138.05 -25.09 0.98 Allowed 'General case' 0 C--N 1.344 0.338 0 CA-C-N 117.828 0.814 . . . . 0.0 111.021 0.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -155.66 148.43 24.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.462 . . . . 0.0 111.639 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.507 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 86.5 m -79.11 146.49 33.18 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.0 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.41 131.63 35.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.576 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.96 142.91 46.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.297 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.89 129.8 42.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.119 0.485 . . . . 0.0 110.443 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -13.3 58.1 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.197 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.65 139.91 33.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.456 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.6 127.25 32.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.26 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -111.87 159.71 11.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.606 0.717 . . . . 0.0 112.789 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.426 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -115.39 109.18 17.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.935 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.416 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.12 118.41 33.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.675 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.485 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 15.8 ttp-105 -104.24 116.59 32.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.67 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.2 t-80 -59.78 106.75 0.52 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -51.49 -44.71 62.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -177.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 26.2 t80 -65.6 -59.17 4.23 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 149' ' ' LEU . 59.8 p -78.2 -14.49 59.43 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 73.42 0.87 55.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.383 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -84.58 -164.79 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.441 0.162 . . . . 0.0 110.64 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.423 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.1 m-85 -134.85 138.8 44.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.439 HD13 HD21 ' A' ' 37' ' ' LEU . 24.5 tp -55.97 124.8 18.92 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.593 ' SG ' HD21 ' A' ' 133' ' ' LEU . 19.3 p -134.5 147.72 50.4 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.4 t -93.76 98.52 11.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.643 -1.162 . . . . 0.0 107.891 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.593 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.1 mt -75.7 149.67 38.04 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.283 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.7 t -80.63 4.56 18.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.861 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' THR . . . . . 0.403 HG22 ' HA ' ' A' ' 139' ' ' SER . 79.8 p -93.5 118.87 31.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.755 0.312 . . . . 0.0 111.263 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 48.4 t -66.08 -60.01 3.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.251 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.565 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 1.4 mmp_? -133.85 -37.57 0.91 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.005 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 41.3 t -162.18 78.41 0.51 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.559 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.403 ' HA ' HG22 ' A' ' 135' ' ' THR . 32.1 t 59.05 39.04 23.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.891 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 61.8 p -132.21 -169.16 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -144.62 103.66 3.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.707 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' ' 136' ' ' SER . 68.2 mttm -145.81 102.49 3.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.548 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.425 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 4.4 mm? 59.9 -81.45 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.653 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -100.86 153.77 19.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 112.44 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.534 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 11.0 m-85 -103.32 171.62 7.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.907 177.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -91.01 144.05 26.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.72 118.53 58.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.242 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.21 -150.48 5.9 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.148 -1.025 . . . . 0.0 113.172 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 81.0 mt -116.55 143.63 45.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.051 0.453 . . . . 0.0 110.832 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 1.8 tp60 -131.74 140.82 49.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.583 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.6 -51.49 19.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.509 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.468 ' HB3' HG22 ' A' ' 154' ' ' THR . 10.0 m-20 -84.61 152.17 24.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.541 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.7 p -107.86 -3.93 18.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.731 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' THR . . . . . 0.468 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.45 117.68 3.27 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.602 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 121.93 -161.29 16.11 Favored Glycine 0 N--CA 1.441 -0.992 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.829 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.528 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -118.89 -12.21 9.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.707 0.289 . . . . 0.0 111.23 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.34 -31.87 67.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.5 m -89.6 6.85 39.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.655 0.264 . . . . 0.0 111.503 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.9 131.8 54.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.08 0.467 . . . . 0.0 111.305 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.462 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.5 m95 -127.14 115.27 18.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.711 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.5 p -78.13 126.24 30.52 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.152 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.462 HD12 HG21 ' A' ' 175' ' ' VAL . 2.4 pt -87.57 135.19 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 0.0 110.794 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.407 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 83.2 m-70 -127.86 149.35 70.43 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.202 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.651 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.4 Cg_endo -65.4 136.69 47.97 Favored 'Trans proline' 0 CA--C 1.517 -0.341 0 C-N-CA 122.502 2.135 . . . . 0.0 112.323 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.423 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.08 -39.55 49.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.396 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 79.0 p -104.85 -173.12 2.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.516 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -94.11 -7.09 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.931 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.445 ' HB2' ' NH1' ' A' ' 169' ' ' ARG . 2.3 mm100 -73.78 -34.03 64.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.092 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.651 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 69.7 mmt-85 -87.97 145.13 26.16 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.829 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.1 t -127.13 167.97 15.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.459 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.23 133.58 50.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.254 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.35 -16.99 58.55 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.132 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -68.04 156.33 37.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.916 0.389 . . . . 0.0 111.103 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.27 145.47 47.87 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.462 HG21 HD12 ' A' ' 162' ' ' ILE . 91.1 t -95.11 112.38 27.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.94 0.4 . . . . 0.0 110.263 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -77.62 154.56 32.13 Favored 'General case' 0 CA--C 1.5 -0.954 0 CA-C-O 121.353 0.597 . . . . 0.0 111.595 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 45.7 t -70.53 122.14 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.89 -13.3 32.01 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.963 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -70.16 130.13 41.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.73 0.3 . . . . 0.0 110.741 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.486 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 10.4 m-20 -73.51 115.24 12.67 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.462 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -99.84 149.79 23.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.818 0.818 . . . . 0.0 113.122 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.512 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.5 mt -114.26 113.17 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.84 136.87 32.86 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.175 0.512 . . . . 0.0 112.227 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.471 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.3 t -128.77 125.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.764 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 34.5 t -65.19 123.92 20.81 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.4 t -67.44 -33.53 62.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.74 -39.54 35.92 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 65.3 m -113.35 6.94 17.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.25 32.19 0.93 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.425 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 27.6 mtt180 -114.32 141.31 47.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.918 0.39 . . . . 0.0 110.73 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.0 m-85 -72.24 153.54 41.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.25 76.8 2.37 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.407 -2.072 . . . . 0.0 105.407 175.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -76.57 151.31 36.35 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -174.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.8 tp -100.64 117.3 34.48 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.672 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.429 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 42.7 t -111.23 146.33 37.14 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.86 90.31 3.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.617 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -77.12 -174.53 40.77 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.464 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 71.4 m-20 -2.12 -76.62 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.42 0.688 . . . . 0.0 112.594 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 39.7 t -147.62 12.68 1.03 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.05 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.8 p -127.25 -179.86 5.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.1 m95 -107.22 135.92 47.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.207 0.527 . . . . 0.0 111.198 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.617 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 15.5 m80 -127.74 173.1 10.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.108 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.86 131.98 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.104 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -149.33 172.44 14.89 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.66 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.14 94.54 6.56 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.259 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.21 174.83 5.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.129 -177.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -83.76 9.37 12.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.038 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 76.4 mm-40 -115.35 136.85 52.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.534 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.512 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.8 mt-30 -66.29 175.31 2.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 122.295 1.045 . . . . 0.0 113.047 -178.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.9 m -167.98 120.82 0.88 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 113.025 -1.898 . . . . 0.0 107.891 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 37.1 mt -74.74 127.59 33.52 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.976 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.413 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -114.71 146.75 40.56 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.617 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.2 m -113.76 100.04 8.16 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.222 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 22' ' ' LEU . 75.0 t -91.31 99.95 10.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.818 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.0 139.38 22.89 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.122 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.477 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.8 Cg_exo -63.6 106.94 0.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.018 1.812 . . . . 0.0 111.197 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.3 mm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.976 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 79.6 mm-40 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.477 ' CD1' ' HD2' ' A' ' 176' ' ' ARG . 40.5 m-85 -127.7 151.65 48.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.562 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.8 mt -81.36 123.64 28.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -111.04 156.57 21.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.939 0.399 . . . . 0.0 111.069 -179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.8 p -67.19 155.65 38.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.844 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.43 -8.3 1.38 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.77 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -69.05 132.27 46.35 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.913 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -79.29 123.03 27.07 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.484 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.0 m -138.23 169.78 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.678 ' HB ' ' SG ' ' A' ' 36' ' ' CYS . 2.5 m -132.74 136.19 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.335 176.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.716 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.19 126.09 42.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.808 0.337 . . . . 0.0 110.918 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 41.0 mt-30 -125.14 151.06 46.26 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.488 0.661 . . . . 0.0 111.787 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -137.63 144.12 41.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.541 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.7 m -86.12 122.03 29.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.327 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.615 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.07 121.99 44.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.144 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.2 m -125.63 137.66 53.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.991 0.424 . . . . 0.0 111.616 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.0 tt -174.16 143.32 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.582 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 43.5 m80 59.64 39.34 21.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.005 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.429 ' HE2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.4 22.6 13.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.378 179.589 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -126.67 129.09 47.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.612 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -119.61 145.85 46.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.26 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -156.74 174.3 15.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.683 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.536 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 28.0 mtmm -121.41 135.88 55.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.478 178.318 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.8 mt -123.69 143.88 49.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.72 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.678 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 4.3 t -107.11 135.05 49.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.977 0.418 . . . . 0.0 110.56 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.9 tp -59.89 103.3 0.2 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.882 179.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -101.56 164.61 11.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.634 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.59 158.63 11.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.545 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -131.09 150.09 52.31 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.75 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.07 -4.25 89.99 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.918 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -109.04 161.55 15.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.891 0.377 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.69 -141.63 24.76 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.294 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -84.38 11.86 7.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.776 0.322 . . . . 0.0 110.641 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.14 30.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.6 mt -79.59 135.83 36.69 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.7 m -76.75 150.84 36.19 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.304 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -144.89 -170.29 3.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.706 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.6 mt -127.4 143.04 51.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.313 0.578 . . . . 0.0 112.141 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' CD ' HD11 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -111.47 138.33 48.13 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.662 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.506 ' HA ' HD23 ' A' ' 35' ' ' LEU . 32.7 t -77.49 145.83 36.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.486 ' C ' ' H ' ' A' ' 54' ' ' ASN . 72.4 p -103.97 177.22 4.9 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.312 179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 14.8 m -70.0 17.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.652 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.486 ' H ' ' C ' ' A' ' 52' ' ' THR . 27.3 t-20 64.42 -88.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.591 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 58.8 m -127.06 103.19 7.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.989 -179.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 47.1 mmtm -76.47 -179.71 5.37 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 123.074 0.549 . . . . 0.0 110.917 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.536 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -60.41 -107.37 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.796 179.769 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.8 t 61.68 101.41 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 6.6 Cg_exo -75.2 141.38 26.01 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.294 2.663 . . . . 0.0 111.53 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.83 -43.41 29.37 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 C-N-CA 122.543 2.162 . . . . 0.0 111.079 179.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.454 ' O ' HG12 ' A' ' 64' ' ' ILE . 11.1 t70 -119.25 91.89 3.66 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.09 178.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HG11 ' A' ' 21' ' ' VAL . 43.3 tp -72.83 -29.34 63.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.292 -178.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.6 m -54.72 -40.01 68.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 38' ' ' ALA . 21.0 pt -71.66 -16.86 19.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -178.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 37' ' ' LEU . 16.6 t -105.59 4.8 30.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.247 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.1 m -76.24 125.92 30.05 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.2 161.18 35.63 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.8 t -125.11 133.19 70.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.673 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.1 mt -80.7 66.19 6.13 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.7 mm-40 -45.75 -61.39 1.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 55.5 mm-40 -124.37 164.36 19.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.662 0.744 . . . . 0.0 112.816 -177.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.0 t -156.43 84.51 0.98 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.829 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.1 153.23 29.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.489 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.9 p -67.27 148.61 51.49 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.9 t -50.33 -42.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.976 0.417 . . . . 0.0 110.264 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.4 ttp85 -59.67 -50.47 73.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.14 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.03 99.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.755 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.33 -46.05 88.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.182 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -66.7 -33.01 74.69 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.971 0.415 . . . . 0.0 110.583 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.35 -43.65 85.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.463 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.41 ' O ' HG23 ' A' ' 85' ' ' THR . 68.0 mtt -64.46 -41.81 96.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.491 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -67.4 -35.45 79.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.444 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.96 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.614 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -74.39 -22.11 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.306 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 81' ' ' MET . 63.9 p -84.82 1.91 44.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.948 0.404 . . . . 0.0 111.18 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 47.7 t -82.34 -35.67 13.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.004 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -114.6 154.82 27.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.88 100.02 0.38 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.5 m -155.34 127.59 7.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.007 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 62.07 -83.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.462 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.6 37.06 68.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.071 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -64.14 110.57 2.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.862 0.363 . . . . 0.0 111.104 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.03 -179.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.936 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.91 81.53 0.91 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.452 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.523 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 27.7 m -83.11 -2.39 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.024 -179.237 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.826 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 7.7 mm-40 -54.5 -37.79 65.73 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.826 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 51.6 mtmt -86.33 -51.59 6.15 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 120.353 1.433 . . . . 0.0 111.898 -2.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -60.51 -37.35 80.84 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.977 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.622 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 52.5 mttp -57.9 -38.03 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.276 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.821 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.1 t80 -74.04 -44.38 54.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.916 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.6 ttt -57.15 -37.95 72.82 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.431 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.3 mmt -72.36 -43.7 63.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.372 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -62.06 -34.53 76.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.585 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.4 m -72.92 -49.05 31.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.279 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.98 44.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.391 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -70.07 -49.7 48.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.291 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.66 -58.58 13.13 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.618 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 62.79 -128.3 40.25 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.02 -82.77 0.81 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.558 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -95.43 -171.67 2.45 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.83 0.815 . . . . 0.0 110.736 -0.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -151.45 140.8 21.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.276 0.56 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 92.2 m -75.47 146.0 40.99 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.139 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.33 134.33 36.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.1 mt -117.64 142.06 47.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.864 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -61.67 127.96 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.67 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.45 -9.43 55.83 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.968 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -85.39 139.42 31.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 111.079 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.26 127.14 32.38 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.8 pt -112.12 157.7 12.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.587 0.708 . . . . 0.0 112.854 -178.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.411 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -113.26 109.08 18.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.936 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.1 mt -97.06 117.71 31.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.554 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.2 ttp85 -104.22 117.79 35.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.689 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.4 t-80 -60.02 105.45 0.4 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 177.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 45.7 t -46.5 -53.91 10.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.415 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.1 t80 -58.12 -71.48 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.402 ' OG ' HD13 ' A' ' 149' ' ' LEU . 77.9 p -62.21 -25.05 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLY . . . . . 0.513 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 81.87 -0.82 87.93 Favored Glycine 0 C--N 1.322 -0.234 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.288 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 45.9 mtt -83.03 -164.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.489 0.185 . . . . 0.0 110.673 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.456 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.0 m-85 -135.61 139.28 43.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.56 126.1 23.86 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.7 t -136.06 147.97 48.12 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.8 t -94.42 99.07 11.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.8 mt -77.37 146.0 36.93 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.624 -178.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -0.12 17.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.932 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.2 p -88.87 121.6 31.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.72 0.295 . . . . 0.0 110.974 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 42.0 t -71.63 -61.16 1.88 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.712 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -178.39 109.83 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.768 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.5 m 60.24 -85.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.4 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 52.5 m -152.07 -0.71 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.4 p -118.79 -172.26 2.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.329 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 63.69 158.46 0.08 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.229 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -155.35 -11.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.25 -66.21 0.52 Allowed 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 111.128 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -108.31 151.68 25.65 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.573 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 10.5 m-85 -99.49 170.49 8.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.141 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -90.15 143.14 27.04 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.86 116.76 53.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.275 178.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.05 -151.85 6.56 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.881 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 68.7 mt -113.89 147.0 39.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.81 0.338 . . . . 0.0 110.561 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -136.69 140.79 42.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.099 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -74.16 -47.94 32.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.594 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -84.99 146.89 26.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.1 p -107.98 -10.26 15.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.99 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.1 p -54.52 112.37 0.99 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.355 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 131.87 -158.44 22.86 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.341 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.473 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.2 mt-10 -121.8 -14.43 8.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.717 0.294 . . . . 0.0 111.24 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ALA . . . . . 0.423 ' N ' ' HB2' ' A' ' 187' ' ' SER . . . -57.61 -32.79 67.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.174 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.3 m -89.45 5.97 42.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.604 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -110.19 132.56 54.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.111 0.481 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.452 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.47 117.18 21.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.649 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 7.7 p -79.13 128.01 32.75 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.133 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.553 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.26 134.33 28.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.478 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 82.1 m-70 -127.96 151.85 76.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.291 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.666 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.6 Cg_endo -68.78 137.45 38.47 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.504 2.136 . . . . 0.0 112.291 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.415 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.45 -40.41 43.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.438 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.1 p -105.52 -171.12 1.85 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.499 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -95.51 -0.94 51.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.0 -36.06 49.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.989 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.666 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.2 mmp_? -87.57 149.45 24.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.525 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 47.7 t -131.75 161.74 32.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.017 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.27 126.75 29.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.137 179.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.61 -14.91 57.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.688 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.79 156.57 38.77 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -72.93 136.85 45.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.372 178.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.553 HG21 HD12 ' A' ' 162' ' ' ILE . 84.3 t -85.57 119.29 33.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.378 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 11.0 mmm180 -84.6 153.99 22.86 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-O 121.364 0.602 . . . . 0.0 111.513 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.423 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.9 t -69.66 122.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.28 -8.3 38.05 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.295 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -73.09 131.44 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.742 0.306 . . . . 0.0 110.9 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.514 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 24.5 m-20 -72.57 110.97 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 69.0 mt -97.51 149.68 21.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.505 HD13 ' NE2' ' A' ' 209' ' ' GLN . 54.4 mt -114.41 113.17 42.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.13 138.6 31.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.101 0.477 . . . . 0.0 112.069 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.451 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.5 t -130.21 123.66 56.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.81 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 189' ' ' GLU . 87.5 p -65.23 119.15 10.37 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.1 t -63.17 -31.86 54.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.19 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' SER . . . . . 0.423 ' HB2' ' N ' ' A' ' 157' ' ' ALA . 44.2 t -77.49 -39.2 47.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -178.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 m -116.66 9.89 14.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 185' ' ' SER . 0.4 OUTLIER 44.38 32.93 0.78 Allowed 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.584 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 29.0 mtt180 -113.31 140.27 48.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.95 0.405 . . . . 0.0 110.815 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -72.17 153.62 41.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.318 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 31.1 tp -74.82 76.54 2.11 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 175.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -75.98 150.03 37.51 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.3 tp -100.14 116.53 32.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.602 177.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 49.2 p -110.1 145.39 37.22 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -105.82 91.05 3.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.15 178.83 53.43 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.032 179.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.517 ' C ' ' O ' ' A' ' 197' ' ' GLY . 54.5 m-20 9.55 -82.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.326 0.651 . . . . 0.0 112.51 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 47.5 t -143.08 4.11 1.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.527 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.4 p -119.89 -179.35 3.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.195 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.615 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -105.83 139.12 40.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.249 0.547 . . . . 0.0 111.341 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.481 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 19.0 m80 -130.41 172.5 11.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.073 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.26 133.89 67.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.223 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -151.96 170.96 18.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.662 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.48 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -97.61 96.53 8.35 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.97 174.8 5.84 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.113 -177.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -83.57 11.11 7.6 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.051 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 68.8 mt-30 -117.63 135.76 53.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.441 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.505 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.0 mt-30 -65.56 175.23 1.89 Allowed 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 122.31 1.052 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.4 m -168.62 120.82 0.8 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.084 -1.871 . . . . 0.0 107.836 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 27.9 mt -74.88 129.11 37.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.077 0.465 . . . . 0.0 109.85 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.0 m95 -116.06 146.74 41.95 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.632 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 45.7 t -113.7 101.77 9.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.133 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.716 HG22 ' HG ' ' A' ' 22' ' ' LEU . 79.3 t -92.88 101.78 12.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.779 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.84 140.3 23.87 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.2 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.423 ' HD3' HG13 ' A' ' 177' ' ' VAL . 24.0 Cg_exo -63.74 104.03 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 121.975 1.783 . . . . 0.0 110.984 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 62' ' ' LEU . 3.8 mm . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.383 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 14.9 mm100 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.706 0.288 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -119.37 154.64 33.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.694 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.0 mt -82.51 121.67 27.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.442 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.26 157.16 19.1 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.012 0.434 . . . . 0.0 111.086 -179.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.402 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.6 p -68.27 156.63 37.28 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.45 -8.94 1.11 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.701 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.442 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.8 m-20 -67.91 135.35 52.33 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -82.0 118.05 22.69 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.504 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.2 m -134.83 172.62 15.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.666 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -134.91 139.31 47.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.2 176.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.796 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.5 mp -100.0 120.93 40.59 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.689 0.281 . . . . 0.0 110.662 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.46 ' OE1' HG21 ' A' ' 52' ' ' THR . 24.2 mt-30 -118.19 160.19 22.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.438 0.637 . . . . 0.0 111.793 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -146.76 143.61 28.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.319 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -88.04 121.59 30.63 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.054 0.454 . . . . 0.0 110.405 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.617 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.0 121.72 45.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.978 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 m -126.22 130.09 50.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.986 0.422 . . . . 0.0 111.86 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.8 tt -168.74 149.23 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.51 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 44.0 m80 59.28 39.32 22.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.11 23.67 13.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -127.77 147.17 50.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.455 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -131.75 148.78 52.6 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.967 0.413 . . . . 0.0 111.028 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -161.67 165.28 28.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.672 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HE3' ' HB3' ' A' ' 57' ' ' ASN . 37.9 mtmt -113.32 135.22 54.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.428 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 51' ' ' SER . 2.3 mt -124.69 142.33 51.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.728 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.601 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 47.6 t -106.36 145.58 31.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.4 . . . . 0.0 110.588 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 130' ' ' LEU . 33.4 tp -65.32 114.59 4.87 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.585 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.492 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -113.8 164.61 13.52 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.417 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.434 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -169.02 161.1 10.4 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.594 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.67 144.17 51.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.724 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.8 -9.23 86.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.775 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -106.01 162.87 13.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 111.146 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.97 -142.5 26.52 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.477 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 19.6 p30 -83.02 9.71 9.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.747 0.308 . . . . 0.0 110.833 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.29 0.38 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.177 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.2 mt -79.44 137.59 37.3 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.938 0.399 . . . . 0.0 110.487 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.4 m -77.91 153.89 32.17 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.634 0.73 . . . . 0.0 111.524 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -148.34 -166.11 2.45 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.319 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 37' ' ' LEU . 25.5 mt -130.44 143.89 51.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.299 0.571 . . . . 0.0 112.429 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 mt-10 -111.26 141.46 44.76 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.594 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.468 ' HA ' HD23 ' A' ' 35' ' ' LEU . 48.0 t -81.94 142.39 32.48 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.505 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 51.5 p -104.67 166.65 10.25 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.561 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 17.7 m -53.69 -21.17 6.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.464 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.9 t30 64.25 113.3 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.68 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.458 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 80.8 p 46.87 74.92 0.13 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.774 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HE2' HG21 ' A' ' 58' ' ' VAL . 23.2 pttm -83.86 169.14 15.43 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 122.841 0.457 . . . . 0.0 110.481 -0.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.535 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 6.6 p-10 -58.16 -102.82 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.116 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.477 HG21 ' HE2' ' A' ' 56' ' ' LYS . 32.9 t 60.82 100.04 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -74.99 140.37 25.39 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.393 2.729 . . . . 0.0 111.451 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.6 Cg_endo -51.24 -38.86 62.34 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.392 2.061 . . . . 0.0 111.459 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -120.59 81.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.676 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.575 HD11 HG11 ' A' ' 21' ' ' VAL . 45.2 tp -63.01 -30.33 71.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.541 -178.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.2 p -45.26 -56.63 4.66 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.492 HD12 ' HB1' ' A' ' 38' ' ' ALA . 30.4 pt -67.98 -18.24 23.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.666 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.59 -3.29 46.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.917 0.389 . . . . 0.0 111.679 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.459 HG22 ' OG ' ' A' ' 124' ' ' SER . 23.0 m -83.66 134.74 34.77 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -138.82 163.62 31.77 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 t -127.61 133.83 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.408 HD11 HG11 ' A' ' 20' ' ' VAL . 20.5 mt -82.45 65.33 7.53 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.8 mm-40 -45.22 -66.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.498 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 8.1 mm100 -119.25 166.61 12.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.743 0.783 . . . . 0.0 113.1 -177.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.4 t -159.62 82.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.402 -1.272 . . . . 0.0 108.746 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.41 HD13 ' SD ' ' A' ' 81' ' ' MET . 5.9 mt -111.6 157.11 20.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.388 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 t -69.13 150.04 47.99 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 41.3 t -52.88 -42.94 44.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.06 0.457 . . . . 0.0 110.18 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -59.24 -51.74 68.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.25 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -63.62 -41.15 98.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.721 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.81 -44.32 96.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.001 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -68.29 -34.03 75.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.911 0.386 . . . . 0.0 110.645 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -66.66 -41.57 87.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.704 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.431 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.3 mtt -64.31 -44.89 90.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.668 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 86' ' ' VAL . 82.2 mt -66.58 -34.76 78.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.16 75.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.049 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -74.4 -19.46 60.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.681 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 81' ' ' MET . 71.5 p -85.88 -12.11 51.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.764 0.316 . . . . 0.0 111.466 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 82' ' ' LEU . 20.4 t -78.03 -37.18 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.906 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -120.24 179.94 4.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -60.31 149.52 33.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.81 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.5 t -83.14 154.43 24.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.994 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -90.2 98.1 11.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.87 -12.61 8.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.473 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 59.9 101.4 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.832 0.349 . . . . 0.0 111.183 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 m -61.01 -40.43 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.288 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -94.28 85.27 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.366 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.7 t -84.23 -11.08 11.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.915 0.388 . . . . 0.0 111.516 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.759 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 15.3 mm-40 -53.79 -44.17 69.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.644 -0.694 . . . . 0.0 112.74 -179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.725 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 46.9 mtmt -86.27 -49.81 7.42 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 0.0 110.881 -2.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.432 ' O ' ' HG2' ' A' ' 102' ' ' MET . 49.0 t90 -53.97 -43.66 70.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.651 -178.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.612 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -58.37 -30.3 66.68 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.153 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.759 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 9.8 t80 -73.87 -47.52 37.59 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.523 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 14.9 tpt -56.71 -38.62 72.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.603 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 98' ' ' TRP . 91.2 mmm -72.74 -43.37 63.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -57.45 -40.01 77.53 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.474 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 74.1 p -72.45 -46.83 53.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.97 -26.61 67.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -90.26 -32.07 16.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.894 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.62 -49.16 52.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.668 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -66.09 176.19 17.7 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.804 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.632 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . -69.12 -173.79 9.54 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-O 119.413 -0.659 . . . . 0.0 112.618 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' HIS . . . . . 0.632 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 45.5 m80 59.04 25.64 14.13 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.959 1.38 . . . . 0.0 111.93 -0.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -84.34 146.41 27.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.124 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.7 m -75.8 146.7 39.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.287 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.2 131.68 35.31 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.768 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -116.04 141.98 47.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.244 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.58 129.13 39.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.451 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.16 -13.43 57.24 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.951 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.37 141.93 32.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.053 0.454 . . . . 0.0 111.303 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.74 125.22 31.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.3 pt -110.31 160.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.528 HD21 HG21 ' A' ' 153' ' ' THR . 20.0 tp -116.84 111.62 19.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.036 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.402 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.7 mt -98.82 117.69 33.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 17.2 ttp-105 -103.24 115.53 30.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.763 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.9 t-80 -58.18 108.19 0.57 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.459 ' OG ' HG22 ' A' ' 66' ' ' THR . 44.0 m -52.82 -46.27 67.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 60.4 t80 -63.33 -59.28 4.92 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 t -78.27 -17.0 57.24 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.67 -2.33 59.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.552 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 62.3 mtm -84.13 -167.11 1.63 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.463 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 63.5 m-85 -130.93 139.0 50.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 37' ' ' LEU . 30.3 tp -54.87 128.69 34.32 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 46.2 t -137.72 147.78 45.07 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.5 t -95.07 98.38 10.62 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.8 mt -75.33 153.43 37.86 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.618 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.0 t -80.66 -4.59 54.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.769 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 32.4 p -83.95 122.01 28.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.728 0.299 . . . . 0.0 111.131 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 50.8 m -69.28 -60.52 2.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -173.9 -57.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 52.6 m -134.31 -78.66 0.46 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.882 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.7 t -178.64 13.02 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 75.9 p -118.91 -11.78 9.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.46 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.24 150.71 37.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.246 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -143.39 -3.98 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.684 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.63 -66.48 0.51 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -109.35 154.4 22.59 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.641 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.496 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 15.6 m-85 -101.61 172.22 7.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.143 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -90.52 145.13 25.13 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 92.7 t -115.2 117.39 55.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.307 178.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.39 -149.58 5.84 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.87 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.0 mt -114.63 150.03 35.73 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.852 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -137.4 139.34 40.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.775 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -68.63 -68.43 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.543 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -74.97 154.35 38.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.712 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.528 HG21 HD21 ' A' ' 120' ' ' LEU . 81.4 p -106.3 3.96 28.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.013 0.435 . . . . 0.0 111.096 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 74.9 p -59.15 114.12 2.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.312 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.35 -164.39 18.94 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.656 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.8 mt-10 -116.27 -13.8 11.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.676 0.274 . . . . 0.0 111.306 -179.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.34 65.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.198 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 30.0 p -88.83 6.67 37.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.632 0.253 . . . . 0.0 111.674 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -110.4 133.53 53.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.153 0.501 . . . . 0.0 111.347 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.3 m95 -127.78 115.96 19.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.623 -179.059 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.4 p -78.12 123.33 26.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.049 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.435 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -85.89 136.93 21.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.99 0.424 . . . . 0.0 110.982 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -128.75 149.84 73.24 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.034 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.665 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 38.5 Cg_endo -66.71 137.79 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.449 2.1 . . . . 0.0 112.38 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 180' ' ' ASP . . . -75.61 -42.47 51.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -107.92 -169.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -91.64 -8.59 46.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.066 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -67.98 -38.31 82.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.047 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.665 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.6 mmp_? -88.59 150.84 22.85 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.824 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 60.4 m -133.28 167.83 19.67 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.881 0.372 . . . . 0.0 111.011 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.53 127.94 34.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.528 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.27 -14.72 63.28 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.086 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.53 155.98 40.01 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.031 0.443 . . . . 0.0 111.313 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 43.9 mttp -72.56 141.48 48.45 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.451 HG13 HD21 ' A' ' 181' ' ' LEU . 86.1 t -91.11 120.92 40.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.437 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 18.8 mmt180 -84.8 153.81 22.74 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-O 121.156 0.503 . . . . 0.0 111.381 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.446 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.7 t -69.11 122.22 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.39 -14.77 35.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.399 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.33 127.13 31.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.947 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.9 m-20 -68.52 110.06 4.02 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.451 HD21 HG13 ' A' ' 175' ' ' VAL . 69.4 mt -96.36 149.23 21.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.79 0.805 . . . . 0.0 112.924 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.06 112.51 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.9 mp -92.96 135.64 33.97 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.14 -178.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.465 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.9 t -127.75 127.75 68.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.75 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -64.43 127.86 33.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -71.22 -31.82 45.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.698 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.0 t -80.08 -36.65 35.22 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 60.4 p -116.74 2.4 12.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 50.42 28.31 3.24 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 179.772 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 26.0 mtt180 -108.89 140.76 41.92 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.937 0.399 . . . . 0.0 110.99 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.3 m-85 -72.03 153.77 41.55 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.42 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 28.5 tp -75.31 76.72 2.41 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 105.253 -2.129 . . . . 0.0 105.253 175.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -76.82 149.66 36.18 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 115.454 1.649 . . . . 0.0 115.454 -174.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.1 tp -99.0 115.02 27.97 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 113.78 -1.554 . . . . 0.0 107.622 177.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.0 t -107.83 146.54 32.11 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -177.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -106.0 91.89 3.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.575 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -79.49 -175.07 47.05 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.36 -0.924 . . . . 0.0 111.507 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 79.6 m-20 -0.25 -78.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.379 0.671 . . . . 0.0 112.386 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 79.3 p -146.2 12.65 1.23 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.095 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 77.0 p -126.57 -178.54 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.868 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.617 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.6 m95 -107.81 136.3 47.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.223 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.575 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 14.0 m80 -129.15 173.27 10.63 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.949 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.45 131.27 71.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.204 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -147.72 170.19 18.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.544 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.61 94.19 6.84 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.216 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.79 176.5 4.99 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.09 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.32 7.96 20.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.1 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -114.43 136.37 53.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.733 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.81 174.52 1.82 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.45 1.119 . . . . 0.0 113.119 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.8 m -168.61 119.86 0.78 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 112.886 -1.961 . . . . 0.0 107.72 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 48.7 mt -73.68 129.8 38.69 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.956 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -116.89 138.5 51.49 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.738 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.7 m -105.44 100.65 10.22 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.711 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.796 HG22 ' HG ' ' A' ' 22' ' ' LEU . 87.4 t -91.96 101.58 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.777 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.89 142.32 28.22 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.196 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.446 ' HD3' HG13 ' A' ' 177' ' ' VAL . 27.0 Cg_exo -62.76 104.97 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.18 1.92 . . . . 0.0 111.116 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.504 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.5 mm . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.24 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' NE2' ' HB ' ' A' ' 177' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 121.017 0.437 . . . . 0.0 111.365 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -116.66 156.07 27.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.545 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.3 mt -81.04 122.72 27.66 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -110.0 156.83 19.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.063 0.459 . . . . 0.0 111.093 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.5 p -68.2 155.33 39.88 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.753 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 71.97 -4.03 2.06 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.753 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.46 134.43 45.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.623 179.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -81.26 120.98 25.59 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.473 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.84 171.61 15.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -177.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.497 HG11 HD11 ' A' ' 62' ' ' LEU . 3.2 m -132.82 137.4 54.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.349 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -98.11 124.87 42.86 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.475 ' OE1' ' HB2' ' A' ' 57' ' ' ASN . 21.6 mt-30 -125.64 143.32 51.08 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.439 0.638 . . . . 0.0 112.339 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -128.89 144.08 51.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.851 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -86.61 120.58 28.08 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.134 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.19 121.25 44.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.258 -179.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 m -124.5 137.63 54.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.622 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.8 tt -177.64 146.16 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.581 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 47.8 m80 58.97 40.12 22.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.183 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 60.64 22.03 11.9 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.283 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -126.46 138.4 53.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.452 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -126.65 147.63 49.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.974 0.416 . . . . 0.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -159.39 172.84 17.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.564 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 27.7 mtmm -120.47 140.42 51.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.45 178.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.566 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.4 mt -128.97 143.57 50.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.424 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.9 p -106.96 138.33 43.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.014 0.435 . . . . 0.0 110.722 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.549 ' HA ' HD23 ' A' ' 49' ' ' LEU . 29.5 tp -60.08 111.04 1.36 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.091 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.39 165.68 11.76 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.599 -179.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.87 163.36 13.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.811 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -134.67 145.35 48.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.522 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.92 12.18 58.18 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.782 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -121.14 151.39 39.96 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.926 0.393 . . . . 0.0 110.808 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.9 -137.34 18.52 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -83.31 8.99 11.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.789 0.328 . . . . 0.0 110.893 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.28 31.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.099 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.52 135.06 37.24 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 110.509 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.3 m -75.66 150.52 37.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.56 0.695 . . . . 0.0 111.297 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -144.03 -167.13 2.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 108.594 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 37' ' ' LEU . 29.8 mt -131.87 142.82 49.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.7 mt-10 -107.23 136.64 46.72 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.794 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.566 ' HA ' HD23 ' A' ' 35' ' ' LEU . 76.7 p -79.84 134.01 36.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.537 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 69.5 p -102.66 150.33 23.54 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.727 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.3 m -65.44 -7.51 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.545 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 65.64 130.65 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.741 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.685 ' N ' ' H ' ' A' ' 57' ' ' ASN . 38.0 t 57.96 85.2 0.09 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 41.0 ttmt -100.39 78.96 2.07 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.252 0.621 . . . . 0.0 111.146 -0.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.685 ' H ' ' N ' ' A' ' 55' ' ' SER . 3.8 p-10 39.12 36.44 0.18 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.073 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.92 106.63 0.98 Allowed Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 4.6 Cg_exo -79.99 140.46 14.29 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.784 2.323 . . . . 0.0 110.918 177.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -46.8 -40.16 24.59 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.543 2.162 . . . . 0.0 111.467 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.414 ' O ' HG12 ' A' ' 64' ' ' ILE . 12.9 t70 -130.93 92.34 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.592 179.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 HG11 ' A' ' 21' ' ' VAL . 48.3 tp -68.37 -29.14 67.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.031 -178.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.2 m -53.14 -48.74 67.68 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.455 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -68.27 -17.68 22.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 61.2 m -99.92 13.75 32.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -92.01 130.97 37.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.567 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.7 159.12 42.84 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.259 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.562 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -123.51 133.68 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.606 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.9 mt -81.72 64.77 6.57 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.511 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.5 mm-40 -44.13 -61.28 1.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -178.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -125.21 165.4 18.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.706 0.765 . . . . 0.0 112.889 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -157.82 85.67 0.9 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.935 179.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -113.84 159.22 20.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.469 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.432 ' HB2' HH12 ' A' ' 76' ' ' ARG . 9.4 m -70.25 149.13 47.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 56.1 t -52.0 -45.05 40.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.004 0.43 . . . . 0.0 110.219 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.432 HH12 ' HB2' ' A' ' 74' ' ' SER . 1.9 tmm_? -57.37 -54.55 45.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.26 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -58.75 -44.96 90.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.909 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.6 tp -60.67 -47.17 87.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.444 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.67 -34.61 78.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.868 0.365 . . . . 0.0 110.669 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -66.27 -40.9 90.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.854 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.1 mtt -63.86 -45.77 87.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.861 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.59 -34.37 76.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.874 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.26 -34.04 75.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.952 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -69.51 -26.5 64.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.361 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 p -78.62 -12.89 60.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.742 0.306 . . . . 0.0 111.219 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 t -75.05 -51.12 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.042 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -99.61 120.62 39.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.813 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -96.37 135.36 38.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 77.0 p -161.52 178.38 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.765 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -75.75 147.66 39.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 106.61 -22.45 30.4 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.749 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 57.25 -168.68 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.71 0.29 . . . . 0.0 110.802 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.57 -37.11 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.912 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -85.47 77.34 9.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.001 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.492 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 35.6 m -82.45 2.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.883 -178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.824 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 2.2 mm-40 -53.76 -38.22 64.19 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.791 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.824 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 56.2 mtpt -87.43 -51.85 5.7 Favored 'General case' 0 C--N 1.353 0.75 0 CA-C-N 120.324 1.42 . . . . 0.0 111.592 -3.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -66.31 -28.48 68.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.918 -1.492 . . . . 0.0 113.031 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.638 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.2 mptm? -60.29 -45.88 91.79 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.876 -0.729 . . . . 0.0 110.132 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PHE . . . . . 0.659 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 22.6 t80 -74.14 -41.95 60.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.261 179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -56.83 -46.35 81.75 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.982 0.42 . . . . 0.0 110.557 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.1 tmm? -71.04 -41.98 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.736 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -57.47 -40.39 78.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.745 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 49.2 p -73.05 -52.71 13.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.273 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.71 -27.45 62.97 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.459 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -85.52 -52.73 5.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.741 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.44 -62.02 6.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.532 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 53.65 -100.25 0.06 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.607 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -157.27 -170.76 22.52 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.336 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -84.61 -164.63 1.0 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 117.631 0.716 . . . . 0.0 110.819 -0.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -157.89 147.01 19.55 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.144 0.497 . . . . 0.0 111.5 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 98.0 m -79.56 146.74 32.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.16 131.92 35.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.826 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.28 141.98 47.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.041 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -62.32 126.07 26.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.093 0.473 . . . . 0.0 110.59 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.48 -11.34 50.61 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.053 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -84.07 141.26 31.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.06 126.97 32.61 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.2 pt -112.05 160.27 11.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.564 0.697 . . . . 0.0 112.777 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 153' ' ' THR . 20.3 tp -115.78 110.38 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.053 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.405 ' CD2' HD23 ' A' ' 69' ' ' LEU . 61.9 mt -98.4 116.51 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.641 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.562 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.1 ttp85 -102.81 116.38 32.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.62 179.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.7 t-80 -59.37 106.54 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 177.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.2 t -50.72 -45.65 58.64 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.454 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 37.5 t80 -65.27 -59.55 3.94 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.4 m -75.76 -16.42 60.13 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -3.35 48.49 Favored Glycine 0 N--CA 1.454 -0.159 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.379 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 61.9 mtm -84.76 -166.25 1.42 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.486 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.1 m-85 -131.67 140.53 49.36 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -177.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.416 HD13 HD21 ' A' ' 37' ' ' LEU . 27.8 tp -55.23 129.55 38.75 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.0 t -138.69 149.26 44.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.1 t -96.4 95.98 8.41 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 176.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.4 mt -71.85 154.53 41.2 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.412 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.2 m -83.96 3.58 33.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.048 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.1 p -90.8 127.19 36.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.717 0.294 . . . . 0.0 111.018 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.0 p -67.53 -60.36 2.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.846 0.355 . . . . 0.0 110.75 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -172.2 -78.08 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 56.6 p -127.25 -67.82 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.037 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -167.78 16.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.845 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 63.1 m -58.4 -77.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.145 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -160.18 -81.3 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.98 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -170.73 -92.96 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.203 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 143' ' ' LEU . 2.2 mm? 55.95 -85.73 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.436 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -107.31 150.7 26.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.154 0.502 . . . . 0.0 111.361 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.528 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 12.4 m-85 -98.12 167.2 11.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.264 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -87.05 145.51 26.44 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.041 0.448 . . . . 0.0 109.96 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 89.7 t -115.06 116.56 52.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.51 -151.62 6.25 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.705 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.5 mt -112.67 148.55 34.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.949 0.404 . . . . 0.0 110.737 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -137.77 140.19 40.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.87 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.5 -77.87 0.06 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.674 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.05 153.06 44.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 120' ' ' LEU . 73.2 p -104.3 4.02 33.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.099 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.4 p -56.2 115.46 2.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.67 -162.29 16.53 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.636 -0.792 . . . . 0.0 111.741 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.536 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.1 mt-10 -118.97 -9.96 9.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.707 0.289 . . . . 0.0 111.39 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.93 -31.13 68.39 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -91.18 8.1 37.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.583 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.6 133.09 54.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.458 . . . . 0.0 111.183 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' TRP . . . . . 0.469 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.8 m95 -128.57 117.41 21.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.779 -178.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 10.7 p -79.2 125.99 30.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.136 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' ILE . . . . . 0.508 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -87.69 136.41 23.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.928 0.394 . . . . 0.0 110.938 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -128.6 150.94 76.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.087 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.716 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.0 Cg_endo -67.84 140.92 52.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.488 2.125 . . . . 0.0 112.286 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.87 -46.22 54.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.809 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.457 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 58.9 m -112.92 -171.09 1.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.44 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' LYS . . . . . 0.483 ' HG3' ' NE2' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -88.51 8.27 28.9 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.235 -179.624 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.483 ' NE2' ' HG3' ' A' ' 167' ' ' LYS . 8.7 mm-40 -81.36 -37.8 27.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.059 0.457 . . . . 0.0 110.567 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.716 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 78.4 mmt-85 -91.82 150.46 21.06 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.402 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 44.9 t -128.46 166.53 18.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.136 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 128.54 36.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.309 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 98.3 -16.39 60.03 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.877 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -69.1 156.38 38.77 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.929 0.395 . . . . 0.0 111.201 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -72.95 143.48 47.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 162' ' ' ILE . 93.0 t -93.43 118.89 40.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.458 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ARG . . . . . 0.422 HH11 ' N ' ' A' ' 12' ' ' GLN . 26.8 mmt180 -83.39 155.34 23.54 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.322 0.582 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 177' ' ' VAL . . . . . 0.429 ' HB ' ' NE2' ' A' ' 12' ' ' GLN . 30.7 t -69.46 120.95 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -15.13 33.19 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.379 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -65.68 128.76 37.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.697 0.284 . . . . 0.0 110.732 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' ASP . . . . . 0.451 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 3.9 m-20 -69.76 111.17 5.34 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 175' ' ' VAL . 76.8 mt -97.27 148.73 22.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 182' ' ' ILE . . . . . 0.506 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.6 mt -114.65 112.02 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -91.89 138.24 31.71 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.141 0.496 . . . . 0.0 112.108 -178.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' VAL . . . . . 0.495 HG22 ' CD1' ' A' ' 191' ' ' TYR . 88.9 t -129.15 128.21 66.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.797 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -65.48 127.36 31.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 87.8 t -71.93 -33.35 47.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.637 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.7 p -80.42 -36.02 34.29 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 63.2 m -114.83 2.41 14.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 49.31 29.02 2.53 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 190' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.3 mtt180 -111.63 140.19 46.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 110.87 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 191' ' ' TYR . . . . . 0.495 ' CD1' HG22 ' A' ' 184' ' ' VAL . 52.0 m-85 -71.11 155.12 41.14 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.7 tp -75.52 75.83 2.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 193' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.4 t60 -75.46 150.09 38.33 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -174.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.5 tp -100.21 112.6 24.93 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 113.649 -1.614 . . . . 0.0 107.639 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 195' ' ' SER . . . . . 0.407 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 62.9 p -105.0 145.69 30.08 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.23 91.36 3.76 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 197' ' ' GLY . . . . . 0.546 ' HA3' ' CE1' ' A' ' 202' ' ' HIS . . . -78.69 -174.49 44.6 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.511 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 11.9 m-80 -0.42 -78.92 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.302 0.641 . . . . 0.0 112.366 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 50.4 m -146.93 13.19 1.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.927 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.8 p -126.61 -177.81 4.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.917 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 201' ' ' TRP . . . . . 0.643 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.6 m95 -108.56 135.09 50.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.314 0.578 . . . . 0.0 111.341 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 202' ' ' HIS . . . . . 0.546 ' CE1' ' HA3' ' A' ' 197' ' ' GLY . 12.2 m80 -128.33 174.11 9.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.4 p -126.78 132.14 70.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 52.0 p-10 -150.09 167.11 27.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.715 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.486 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.32 95.27 8.79 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.32 173.64 6.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.339 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -81.55 8.01 10.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 208' ' ' GLN . . . . . 0.473 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 74.9 mm-40 -114.67 137.42 51.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.731 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 209' ' ' GLN . . . . . 0.506 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.7 mt-30 -66.13 174.82 2.36 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 122.279 1.038 . . . . 0.0 112.809 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.0 m -168.01 121.02 0.89 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.186 -1.824 . . . . 0.0 107.945 178.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 211' ' ' LEU . . . . . 0.451 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 68.4 mt -75.37 128.06 34.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.98 0.419 . . . . 0.0 109.967 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.64 145.77 42.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.9 m -114.01 102.36 10.11 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.206 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 214' ' ' VAL . . . . . 0.747 HG22 ' HG ' ' A' ' 22' ' ' LEU . 80.4 t -93.39 105.55 16.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.041 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -116.69 141.4 28.07 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.247 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.5 Cg_exo -64.31 104.73 0.53 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.194 1.929 . . . . 0.0 111.192 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 217' ' ' ILE . . . . . 0.473 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.986 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.429 ' HB3' HG23 ' A' ' 112' ' ' THR . 44.4 m-85 . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.958 0.408 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.79 126.09 30.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.435 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 10.5 mmm180 -112.83 156.59 22.63 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.096 0.475 . . . . 0.0 111.226 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 p -67.46 156.09 37.44 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.801 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 70.92 -2.84 2.18 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.856 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.1 m-20 -73.25 133.82 44.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.6 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -80.8 120.49 24.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -136.42 171.98 16.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.568 HG11 HD11 ' A' ' 62' ' ' LEU . 3.3 m -133.09 135.79 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 114.682 -1.145 . . . . 0.0 108.239 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -96.85 123.65 40.61 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.563 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 69.9 mt-30 -120.42 163.05 18.48 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.4 0.619 . . . . 0.0 111.359 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -150.96 139.43 20.48 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.422 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -83.81 121.41 27.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.513 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.612 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.67 119.09 35.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.968 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.4 m -122.91 136.9 55.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.002 0.43 . . . . 0.0 111.695 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.6 tt -171.49 145.32 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.3 m80 59.29 37.84 23.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.42 22.52 13.29 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.503 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.62 131.93 49.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.405 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -118.81 144.42 46.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.025 0.44 . . . . 0.0 111.41 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -154.03 171.93 18.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.631 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -119.41 141.14 49.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.429 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -130.23 141.97 50.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.469 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.8 p -106.38 138.19 43.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.022 0.439 . . . . 0.0 110.531 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.6 tp -60.02 110.46 1.2 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.187 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.454 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.83 165.15 11.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.518 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.92 167.14 9.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.801 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.02 150.62 44.64 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.537 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.11 -2.64 89.34 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.967 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -108.84 156.07 20.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 111.025 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.09 -141.6 23.41 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.276 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.503 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -81.07 7.88 9.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.753 0.311 . . . . 0.0 110.623 179.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.11 30.04 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.847 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 44' ' ' ASN . 41.8 mt -78.26 139.58 38.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.007 0.432 . . . . 0.0 110.415 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.5 m -80.15 150.5 30.17 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.545 0.688 . . . . 0.0 111.208 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -145.04 -168.6 2.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.658 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.8 mt -128.64 143.86 51.04 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.445 0.64 . . . . 0.0 112.031 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.505 -0.774 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.809 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.568 HD11 HG11 ' A' ' 21' ' ' VAL . 52.1 tp . . . . . 0 C--O 1.231 0.13 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t -55.67 -47.22 77.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.454 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.7 pt -68.78 -16.76 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 67.6 m -101.3 13.76 34.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.889 0.376 . . . . 0.0 110.826 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.5 m -91.56 130.18 37.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.717 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -136.78 159.94 40.34 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.097 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.593 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -124.09 132.03 71.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.654 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.5 mt -79.92 65.73 5.17 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.496 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.6 mm-40 -44.53 -64.53 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.469 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -122.81 165.35 16.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 112.963 -177.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.9 m -156.89 86.51 0.98 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.022 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.2 mt -114.22 158.23 21.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.472 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.8 t -70.24 148.19 48.86 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 177.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.407 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.6 t -51.33 -45.1 32.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -57.82 -52.77 64.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.093 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.7 -43.13 99.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.9 tp -61.47 -48.23 82.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.199 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 25.8 mt-30 . . . . . 0 C--N 1.324 -0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.742 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 9.9 tp10 . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 113.124 0.786 . . . . 0.0 113.124 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.742 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.1 pttm -80.74 -26.06 37.62 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.525 1.53 . . . . 0.0 112.698 -0.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -52.16 -57.46 9.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.66 ' H ' ' HG2' ' A' ' 96' ' ' GLU . 1.7 tmtp? -57.08 -52.39 65.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.347 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.425 ' HD1' ' HB2' ' A' ' 96' ' ' GLU . 28.9 m-85 -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.871 0.367 . . . . 0.0 110.599 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 28.3 ttt -71.31 -40.41 70.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.802 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 24.1 ttt -68.35 -35.75 78.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.66 -44.64 70.11 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.479 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 29.2 p -65.93 -38.44 88.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.186 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -68.72 -44.86 72.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.734 179.901 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 . . . . . 0 CA--C 1.527 0.09 0 CA-C-O 121.123 0.487 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.429 HG23 ' HB3' ' A' ' 13' ' ' PHE . 87.8 m -74.03 146.27 43.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.96 133.77 35.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.701 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.5 mt -117.01 141.83 47.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.243 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -61.89 129.7 42.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.067 0.46 . . . . 0.0 110.463 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -12.09 58.05 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.117 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.44 140.75 32.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.096 0.474 . . . . 0.0 111.513 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.28 126.79 32.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.142 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 160' ' ' TRP . 48.2 pt -111.97 159.54 11.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.471 0.653 . . . . 0.0 112.746 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.469 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.2 tp -114.51 108.8 17.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.889 -1.051 . . . . 0.0 109.895 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.408 ' CD2' HD23 ' A' ' 69' ' ' LEU . 67.0 mt -97.01 116.72 29.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.703 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.593 ' NH2' HG21 ' A' ' 68' ' ' VAL . 48.8 ttp85 -102.87 116.49 32.66 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.665 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.2 t-80 -59.47 106.55 0.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 43.1 t -49.76 -47.38 50.97 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 57.5 t80 -64.26 -61.23 2.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.8 t -74.26 -16.83 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.43 -2.77 51.59 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.379 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.2 mtt -83.46 -165.55 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.469 0.176 . . . . 0.0 110.626 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.7 m-85 -133.7 138.86 46.07 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.8 tp -55.65 125.54 21.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.587 ' SG ' HD21 ' A' ' 133' ' ' LEU . 17.7 p -136.26 147.71 47.67 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.4 t -93.15 98.6 11.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.587 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.7 mt -75.53 146.65 40.35 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.374 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -77.95 5.9 8.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.019 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.3 p -97.95 120.56 38.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 66.5 m . . . . . 0 C--N 1.322 -0.617 0 CA-C-O 120.918 0.389 . . . . 0.0 110.264 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.322 0.582 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 11.6 m-85 -100.91 173.32 6.54 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.043 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -92.51 145.13 24.69 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 93.3 t -114.33 116.1 51.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.174 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.54 -152.82 6.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.002 -1.094 . . . . 0.0 113.246 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 52.4 mt -113.22 143.44 44.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.823 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -129.37 141.13 51.14 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.831 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.85 -52.71 13.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.487 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.504 ' HB3' HG22 ' A' ' 154' ' ' THR . 7.5 m-20 -87.66 151.36 23.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.691 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 67.2 p -104.96 -6.34 20.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.823 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . 0.504 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.37 115.59 2.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.467 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.14 -159.22 19.73 Favored Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.654 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.507 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -120.53 -13.9 8.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.719 0.295 . . . . 0.0 111.416 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.83 -33.35 66.68 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.6 m -88.62 6.22 39.28 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -110.02 133.75 52.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.146 0.498 . . . . 0.0 111.418 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.485 ' O ' HG12 ' A' ' 119' ' ' ILE . 56.6 m95 -128.56 117.54 21.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.715 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.427 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 14.4 p -79.1 127.64 32.27 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.095 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -89.64 134.83 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.2 m80 -128.61 151.72 77.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.262 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.705 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.1 Cg_endo -67.85 140.73 51.62 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.5 2.134 . . . . 0.0 112.515 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.83 -44.19 42.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 52.1 m -109.29 -173.64 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.132 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.569 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -90.46 6.15 44.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.147 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.569 HE22 ' HE2' ' A' ' 167' ' ' LYS . 10.5 mm-40 -80.58 -36.53 32.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.488 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.705 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 65.5 mmt-85 -90.0 148.16 23.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.229 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.4 m -127.99 166.8 17.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 111.382 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -66.64 133.81 51.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.235 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.96 -16.91 58.38 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.087 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -67.49 157.3 34.6 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.016 0.436 . . . . 0.0 111.313 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -74.36 140.53 44.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.238 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 88.0 t -90.23 119.84 38.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.371 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 25.7 mmt180 -83.61 154.85 23.53 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-O 121.283 0.564 . . . . 0.0 111.406 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 31.6 t -69.55 120.47 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.94 -7.81 35.95 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.376 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -71.45 129.33 38.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 110.853 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.555 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.2 m-20 -70.8 109.84 5.23 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.432 HD21 HG13 ' A' ' 175' ' ' VAL . 63.9 mt -97.14 149.67 21.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.759 0.79 . . . . 0.0 113.035 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 52.8 mt -114.46 112.94 42.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.83 136.7 33.01 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.161 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.45 HG22 ' CD1' ' A' ' 191' ' ' TYR . 74.1 t -128.73 123.13 58.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.735 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 91.4 p -62.5 125.59 24.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 80.1 t -68.7 -32.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.166 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 89.5 p -77.52 -38.49 48.74 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 41.2 t -115.59 2.95 13.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.38 27.17 3.51 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 20.9 mtt180 -107.79 142.5 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.974 0.416 . . . . 0.0 110.927 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.1 m-85 -73.74 154.9 39.41 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.421 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.0 tp -76.42 76.56 3.16 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.0 t60 -76.81 149.41 36.22 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 115.644 1.72 . . . . 0.0 115.644 -174.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -98.7 119.58 37.68 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.639 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.8 p -113.79 144.37 43.1 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -103.81 92.23 4.33 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.521 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -81.82 -176.86 51.44 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.321 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.521 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.3 m-20 4.28 -80.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.406 0.682 . . . . 0.0 112.449 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 37.5 t -145.24 8.2 1.2 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.019 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 57.3 m -122.39 -177.84 3.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.612 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -108.01 138.14 44.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.169 0.509 . . . . 0.0 111.129 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.5 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 28.3 m-70 -129.79 173.05 11.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.216 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.58 133.38 67.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.23 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.7 171.22 17.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.71 94.94 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.03 173.29 6.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.005 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -82.41 10.56 6.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.413 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 21.6 mt-30 -116.43 137.64 52.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.523 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -67.12 174.91 2.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 122.297 1.046 . . . . 0.0 113.303 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.4 m -169.16 121.7 0.77 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 112.931 -1.94 . . . . 0.0 107.812 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.4 mt -74.74 130.58 39.73 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.018 0.437 . . . . 0.0 109.838 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -118.52 133.08 56.15 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.083 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 52.2 m -99.78 102.17 13.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.998 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 89.3 t -93.26 102.89 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.13 139.76 24.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.452 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.8 Cg_exo -63.8 105.82 0.58 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.134 1.889 . . . . 0.0 111.174 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.485 HG23 HD21 ' A' ' 62' ' ' LEU . 1.5 mm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.022 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 CA--C 1.518 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.15 121.91 26.7 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.48 157.2 19.2 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.104 0.478 . . . . 0.0 111.17 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -67.89 156.03 38.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.586 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 16' ' ' THR . 14.3 m-20 70.99 -3.29 2.06 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.89 -179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.9 m-20 -73.58 133.23 43.48 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -79.69 119.18 22.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.481 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -135.02 174.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.655 HG11 HD11 ' A' ' 62' ' ' LEU . 3.7 m -134.0 140.94 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.367 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -102.64 116.64 32.99 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.789 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.522 HE22 ' HE2' ' A' ' 34' ' ' LYS . 17.9 mt-30 -119.15 138.42 52.94 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.453 0.644 . . . . 0.0 112.259 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.0 p -123.06 143.8 49.72 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.648 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.7 m -84.35 123.18 29.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.391 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.563 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.59 122.04 45.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.338 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.1 m -125.01 136.21 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.62 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.3 tt -172.75 144.5 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.366 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.0 m80 58.59 37.5 25.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.918 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.441 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.76 26.21 15.5 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.327 179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -128.18 132.61 48.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.33 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -122.77 145.17 48.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.076 0.465 . . . . 0.0 111.396 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -156.39 178.62 10.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.783 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.522 ' HE2' HE22 ' A' ' 23' ' ' GLN . 32.7 mtmm -124.14 137.41 54.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.513 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.94 132.15 50.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.808 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.8 p -94.11 145.83 24.4 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.418 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.2 tp -69.2 108.94 3.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.081 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -106.18 164.0 12.35 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.305 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.93 164.71 13.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.44 140.86 39.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.659 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.01 17.25 28.36 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.246 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -121.29 146.11 47.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.691 0.282 . . . . 0.0 110.469 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.12 -135.15 14.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.371 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.422 HD22 ' C ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -84.02 9.16 13.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 110.996 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.06 33.63 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.222 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 25.4 mt -79.94 136.15 36.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.976 0.417 . . . . 0.0 110.652 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.9 m -76.9 151.28 35.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.539 0.685 . . . . 0.0 111.219 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -146.02 -170.74 3.55 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.736 -1.12 . . . . 0.0 108.538 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.3 mt -126.41 145.75 50.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.483 0.659 . . . . 0.0 112.06 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.503 -0.855 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.655 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.9 m -51.25 -44.43 61.73 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.497 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.8 pt -72.46 -20.83 19.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.4 m -98.94 13.18 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.75 0.31 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -89.25 129.56 35.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.133 0.492 . . . . 0.0 111.896 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -136.58 162.19 33.8 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.907 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.594 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.9 132.35 70.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.698 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 16.6 mt -80.47 66.7 6.07 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.519 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.3 mm-40 -46.75 -61.91 1.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -122.58 163.05 20.68 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.793 0.806 . . . . 0.0 112.899 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.6 t -156.1 83.33 1.0 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.819 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 mt -113.17 153.75 27.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.557 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.1 t -67.8 147.12 53.0 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 52.6 t -48.79 -44.64 15.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.106 0.479 . . . . 0.0 110.352 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -57.54 -53.7 55.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.225 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.63 -43.37 97.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.787 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.48 -46.68 89.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.349 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 49.8 mt-30 . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 120.807 0.337 . . . . 0.0 110.845 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.8 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 4.8 mm-40 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.8 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 34.2 mtmm -87.17 -51.14 6.16 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 125.059 1.344 . . . . 0.0 111.652 -2.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -58.99 -33.89 71.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.141 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.696 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 32.3 mtmm -62.86 -36.56 83.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.358 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.775 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 37.1 t80 -74.15 -48.0 32.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.885 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.7 ttt -58.31 -37.29 74.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.608 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 45.7 ttm -73.0 -43.86 61.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.827 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.28 -44.14 88.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.915 0.388 . . . . 0.0 110.744 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.2 p -71.29 -40.56 70.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.42 33.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.938 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.607 ' HA ' HE21 ' A' ' 106' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.89 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 121.072 0.463 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.0 m -78.71 148.2 33.16 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.124 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.19 132.47 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.672 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.2 mt -116.89 143.78 45.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.215 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -63.88 133.74 53.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.09 0.472 . . . . 0.0 110.469 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.89 -12.44 64.14 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.996 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.98 139.9 33.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.069 0.462 . . . . 0.0 111.509 -179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -82.13 126.51 32.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.7 pt -111.45 160.93 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.536 0.684 . . . . 0.0 112.773 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.432 HD21 HG21 ' A' ' 153' ' ' THR . 20.1 tp -116.97 108.97 16.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.866 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.411 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -96.44 117.72 31.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.613 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.594 ' NH2' HG21 ' A' ' 68' ' ' VAL . 46.8 ttp85 -103.25 116.77 33.09 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.758 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.1 t-80 -59.98 106.48 0.51 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 40.3 t -50.76 -44.99 58.68 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.491 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 49.2 t80 -64.85 -60.58 2.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.477 ' OG ' HD13 ' A' ' 149' ' ' LEU . 58.3 p -77.1 -14.53 59.79 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.26 -0.29 48.67 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.233 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -83.78 -165.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -134.42 140.33 46.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 25.9 tp -55.12 125.91 22.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.2 t -135.2 149.39 49.9 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.1 t -95.91 97.79 9.91 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.6 mt -74.18 151.26 40.04 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.681 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 76.2 p -80.79 6.06 14.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.866 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 77.5 p -93.66 123.03 36.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.0 110.986 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.806 179.824 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.485 0 CA-C-O 121.296 0.57 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.8 m-85 -99.41 169.82 9.06 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.218 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -89.23 140.74 29.18 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.712 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.0 t -110.39 117.66 55.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.57 -147.81 5.76 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.73 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 77.2 mt -117.93 148.6 42.02 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.935 0.397 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -141.67 139.38 32.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.803 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.1 -72.91 0.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.16 149.29 45.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . 0.432 HG21 HD21 ' A' ' 120' ' ' LEU . 73.9 p -109.98 -2.8 16.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.205 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.2 p -54.84 116.81 2.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.69 -159.36 18.32 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.591 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.545 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.4 mt-10 -120.42 -10.06 9.35 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.809 0.338 . . . . 0.0 111.141 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.03 -31.95 67.5 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.8 m -93.93 9.52 37.1 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -110.49 131.48 55.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.094 0.473 . . . . 0.0 111.409 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.472 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.7 m95 -126.7 116.43 20.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.579 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 9.6 p -78.93 127.39 31.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.24 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.518 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.72 135.21 26.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.405 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.0 m80 -128.22 150.17 73.28 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.158 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.6 Cg_endo -67.36 139.85 51.01 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.668 2.245 . . . . 0.0 112.153 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.25 -44.93 58.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.697 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.461 ' HB3' HE21 ' A' ' 168' ' ' GLN . 51.0 m -110.98 -171.83 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.249 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.539 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -91.88 11.26 25.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.227 -179.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.539 HE22 ' HE2' ' A' ' 167' ' ' LYS . 7.3 mm-40 -84.74 -34.59 22.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.112 0.482 . . . . 0.0 110.437 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.708 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.5 mmp_? -92.57 147.21 23.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.14 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 31.3 t -126.52 166.46 17.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.826 0.346 . . . . 0.0 111.298 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.5 OUTLIER -65.56 131.66 46.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.463 179.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.87 -14.13 65.9 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.146 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.6 mt-10 -70.51 154.86 41.43 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 111.134 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -70.75 143.75 51.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.518 HG21 HD12 ' A' ' 162' ' ' ILE . 98.2 t -94.02 110.86 24.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.432 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -73.71 153.04 40.23 Favored 'General case' 0 CA--C 1.5 -0.974 0 CA-C-O 121.308 0.575 . . . . 0.0 111.409 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 38.7 t -68.69 121.4 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 176.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.4 -15.26 32.69 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.172 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.05 127.58 32.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 120.833 0.349 . . . . 0.0 110.9 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -68.92 112.25 5.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.484 HD21 HG13 ' A' ' 175' ' ' VAL . 65.3 mt -98.77 149.02 23.3 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.836 0.827 . . . . 0.0 113.166 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.473 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.8 mt -114.57 112.97 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.97 138.98 31.0 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.1 0.476 . . . . 0.0 111.988 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.468 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.9 t -130.77 123.27 54.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.0 t -63.04 122.09 15.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.545 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 79.2 t -65.44 -34.46 70.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 120.806 0.336 . . . . 0.0 111.253 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.9 p -78.03 -39.65 41.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.495 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 49.2 m -113.22 9.63 18.44 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.506 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.56 30.7 0.37 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.718 0.636 . . . . 0.0 112.587 179.257 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.506 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 32.5 mtt85 -111.79 141.4 45.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.939 -179.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 61.3 m-85 -73.0 153.41 40.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.8 tp -75.61 75.65 2.62 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 175.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.407 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 80.8 t60 -75.2 151.63 38.45 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -174.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.9 tp -101.43 119.44 38.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.559 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 35.5 p -113.51 146.73 39.17 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.09 89.61 3.12 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.23 -174.75 43.88 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.214 -0.994 . . . . 0.0 111.515 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.6 m-80 1.11 -78.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.421 0.688 . . . . 0.0 112.417 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 48.9 m -147.09 10.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.099 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.6 p -125.37 -178.85 4.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.941 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.563 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.0 m95 -107.49 135.3 49.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.273 0.559 . . . . 0.0 111.175 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.478 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 25.0 m-70 -126.95 172.72 10.21 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.23 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.32 132.8 70.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.121 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.74 170.52 19.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.549 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.38 96.34 8.3 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.38 -179.46 3.64 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.403 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.6 8.36 28.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.283 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.407 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 82.2 mt-30 -117.21 137.28 52.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.569 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.473 ' NE2' HD13 ' A' ' 182' ' ' ILE . 94.4 mt-30 -64.63 174.51 1.75 Allowed 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 122.295 1.045 . . . . 0.0 112.949 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.3 m -166.58 121.16 1.11 Allowed 'General case' 0 N--CA 1.44 -0.975 0 CA-C-N 113.13 -1.85 . . . . 0.0 107.994 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.3 mt -74.99 128.94 36.76 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.055 0.455 . . . . 0.0 109.89 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.9 m95 -116.53 147.83 41.42 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.456 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 53.1 m -114.86 99.77 7.73 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.462 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.741 HG22 ' HG ' ' A' ' 22' ' ' LEU . 74.0 t -92.09 101.12 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.842 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . 0.415 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -115.58 142.31 28.68 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.056 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.427 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.42 104.32 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.2 1.933 . . . . 0.0 110.995 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.481 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.211 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.25 123.35 27.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 10.5 mmm180 -111.56 156.38 21.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.162 0.505 . . . . 0.0 111.396 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.6 p -67.35 156.62 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.611 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 16' ' ' THR . 8.5 m-20 71.39 -5.05 1.68 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.8 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.2 m-20 -72.68 133.84 44.8 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.684 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.64 121.74 26.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.512 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.24 172.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -177.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.572 HG11 HD11 ' A' ' 62' ' ' LEU . 3.5 m -133.32 136.28 55.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.545 -1.207 . . . . 0.0 108.222 176.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.74 121.96 40.27 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.557 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.458 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.2 mt-30 -118.96 161.31 20.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.375 0.607 . . . . 0.0 111.425 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.94 140.82 24.79 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.497 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.3 m -84.21 120.34 26.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.419 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.61 120.79 42.14 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.01 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.9 m -125.4 129.66 50.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.599 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.51 HG23 ' CD2' ' A' ' 29' ' ' HIS . 15.7 tt -165.21 146.28 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.624 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.51 ' CD2' HG23 ' A' ' 28' ' ' ILE . 43.6 m-70 58.47 44.44 18.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.225 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.447 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 60.27 22.23 11.66 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.854 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -127.62 147.5 50.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.482 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -132.75 148.5 52.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.957 0.408 . . . . 0.0 111.179 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -159.47 173.11 16.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -120.66 137.06 54.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.447 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.9 mt -126.24 141.72 51.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.9 p -104.73 141.83 35.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.022 0.439 . . . . 0.0 110.387 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.3 tp -64.31 109.26 1.84 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.121 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.468 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -107.11 162.69 13.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.545 -179.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.48 164.52 14.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.65 143.21 35.02 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.679 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.84 12.36 42.53 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.267 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -116.72 150.15 38.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.662 0.268 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.88 -138.34 19.27 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.317 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.6 p30 -84.69 11.93 8.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.661 0.267 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.96 29.55 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.269 179.537 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.65 140.85 38.34 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 120.975 0.417 . . . . 0.0 110.626 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.46 152.56 26.05 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.557 0.694 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -146.49 -169.19 3.21 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.581 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -128.06 143.8 51.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.423 0.63 . . . . 0.0 111.964 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.502 -0.87 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.651 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.572 HD11 HG11 ' A' ' 21' ' ' VAL . 42.9 tp . . . . . 0 C--O 1.232 0.134 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.9 p -53.64 -42.71 68.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.468 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.3 pt -72.18 -17.72 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.5 m -101.92 14.27 32.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.651 0.262 . . . . 0.0 111.226 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.1 m -90.67 128.94 36.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.079 0.466 . . . . 0.0 111.719 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -136.35 159.38 41.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.984 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.561 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.2 t -123.23 132.56 71.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.716 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.06 65.87 5.36 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.2 mm-40 -45.24 -67.09 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.476 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 18.6 mm-40 -118.99 164.48 15.41 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.687 0.756 . . . . 0.0 112.82 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.1 t -157.21 82.59 0.92 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.864 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.62 157.37 19.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.419 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.0 t -69.68 146.82 51.29 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.6 t -49.38 -46.06 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 16.8 ttp-105 -55.24 -58.53 7.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.097 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.54 75.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.923 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.3 tp -58.78 -49.32 78.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.243 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 94.7 mt-30 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.781 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.0 mm-40 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.34 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.1 mttt -88.41 -51.37 5.77 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 125.005 1.322 . . . . 0.0 111.225 -3.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -63.2 -28.36 69.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.724 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 23.9 tptm -63.31 -40.76 98.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.119 -0.633 . . . . 0.0 109.912 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.644 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.4 t80 -74.26 -44.12 54.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.949 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.58 -41.28 76.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.391 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.4 tpt -74.97 -41.15 60.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.992 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.464 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.0 ttmp? -57.82 -42.82 85.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.942 0.401 . . . . 0.0 110.552 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 77.0 m -72.06 -48.56 43.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.747 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.1 64.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.8 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.196 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 121.077 0.465 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.468 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 85.6 m -76.25 147.18 38.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.906 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.33 131.12 35.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.756 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.0 mt -115.26 140.9 48.71 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.22 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -61.45 130.04 44.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.008 0.432 . . . . 0.0 110.341 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.35 -13.06 58.54 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.13 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.51 141.28 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.042 0.449 . . . . 0.0 111.359 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.67 128.29 34.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.097 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 41.5 pt -113.39 159.53 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.579 0.704 . . . . 0.0 112.818 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.5 tp -116.09 110.5 18.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.889 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 56.0 mt -97.98 118.01 33.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.469 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.561 ' NH2' HG21 ' A' ' 68' ' ' VAL . 54.4 ttp85 -103.0 116.39 32.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.73 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.529 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.3 t-80 -59.29 105.67 0.36 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 177.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 46.9 t -50.28 -45.56 54.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.529 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.5 t80 -64.2 -61.85 1.99 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.427 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -76.62 -13.75 60.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 72.82 1.34 54.49 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.172 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 53.9 mtt -84.04 -164.98 1.02 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 68.9 m-85 -135.42 138.67 43.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.75 126.2 23.11 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 42.1 t -134.69 148.27 50.28 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.6 t -95.21 96.57 9.28 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.525 -1.216 . . . . 0.0 107.758 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.5 mt -73.96 152.03 40.2 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 89.9 p -83.66 6.41 20.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.083 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.3 p -95.4 121.6 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.724 0.297 . . . . 0.0 111.025 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.772 179.829 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.465 0 CA-C-O 121.401 0.62 . . . . 0.0 112.321 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.53 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.2 m-85 -101.73 170.54 8.1 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.887 -1.051 . . . . 0.0 108.98 178.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.35 142.47 27.7 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 67.7 t -112.71 117.22 54.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.344 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.06 -146.89 5.54 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.844 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 73.1 mt -117.92 152.61 35.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.838 0.352 . . . . 0.0 110.531 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -142.32 140.1 32.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.66 -46.37 46.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.463 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -87.17 143.3 27.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 72.2 p -105.83 -8.54 17.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -53.23 114.44 1.47 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.513 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.91 -155.39 20.19 Favored Glycine 0 N--CA 1.441 -1.028 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.614 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -123.04 -13.94 7.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.704 0.288 . . . . 0.0 111.362 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.53 -32.99 67.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 74.3 m -90.47 8.14 35.33 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -111.55 132.26 54.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.055 0.455 . . . . 0.0 111.486 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.9 m95 -126.75 118.41 24.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.661 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -80.08 126.59 31.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.98 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.444 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -88.19 135.8 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -128.77 150.72 75.72 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.253 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.679 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.16 138.87 53.33 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.585 2.19 . . . . 0.0 112.349 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.19 -40.29 45.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.557 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 96.0 p -109.05 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.6 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.76 5.05 53.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.655 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -85.48 -29.56 24.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.041 0.448 . . . . 0.0 110.866 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.679 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 73.9 mmt-85 -92.11 146.71 23.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.374 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 45.1 t -129.52 167.55 17.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.322 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.24 136.19 56.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.376 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.48 -15.91 55.15 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.459 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 170' ' ' SER . 30.8 mt-10 -68.36 155.48 39.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.026 0.441 . . . . 0.0 111.254 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -73.38 141.47 47.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.43 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 162' ' ' ILE . 98.1 t -91.07 123.1 43.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.375 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -87.69 154.67 20.4 Favored 'General case' 0 CA--C 1.496 -1.126 0 CA-C-O 121.266 0.555 . . . . 0.0 111.405 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.76 120.95 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.62 -11.63 30.3 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.907 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -72.21 126.73 30.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.75 0.309 . . . . 0.0 110.779 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.562 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.4 m-20 -69.49 115.5 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 73.9 mt -100.31 148.26 24.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.763 0.792 . . . . 0.0 112.961 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.445 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.6 mt -113.49 112.75 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 176.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.4 mp -93.16 139.45 30.58 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.073 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 191' ' ' TYR . 71.4 t -130.8 127.8 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.718 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 4.3 m -65.05 124.95 23.44 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 94.2 t -69.1 -32.07 52.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.716 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.88 -36.2 36.9 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 61.3 m -116.64 4.9 13.17 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -177.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.15 31.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.467 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 30.0 mtt85 -112.25 141.69 45.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.2 m-85 -72.88 152.92 41.24 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.418 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 30.5 tp -75.11 76.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.442 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -76.88 150.12 36.04 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.1 tp -99.87 119.09 37.66 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.627 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 55.6 p -113.48 147.7 37.36 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -107.0 90.8 3.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -174.49 45.7 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.411 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 18.0 m120 0.6 -78.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.397 0.679 . . . . 0.0 112.449 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 57.4 m -147.68 12.85 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.126 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 54.6 m -126.9 -178.14 4.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.56 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.9 m95 -107.88 134.44 50.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.175 0.512 . . . . 0.0 111.158 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.494 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 27.6 m-70 -126.46 172.46 10.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.1 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.93 131.59 70.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.237 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -148.73 172.09 15.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.655 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.25 95.54 7.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.022 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.9 -179.03 3.52 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.299 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -88.61 7.94 30.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.442 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.17 138.33 51.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.584 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.445 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.4 mt-30 -68.37 173.41 4.9 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.274 1.035 . . . . 0.0 112.828 -178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -164.79 120.4 1.43 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 113.121 -1.854 . . . . 0.0 107.843 178.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.5 mt -73.89 127.52 33.06 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.47 -0.492 . . . . 0.0 109.943 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.418 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.76 140.92 48.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.731 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.2 t -107.9 100.45 9.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.55 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 65.0 t -92.16 102.93 14.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.781 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.27 142.09 28.13 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.349 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.426 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.2 Cg_exo -63.54 103.99 0.42 Allowed 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.218 1.946 . . . . 0.0 111.165 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.512 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.0 mm . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.295 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.452 ' HB3' HG23 ' A' ' 112' ' ' THR . 68.6 m-85 . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 120.655 0.264 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.1 mt -76.91 120.61 22.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.7 mmm180 -109.87 156.19 20.71 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.066 0.46 . . . . 0.0 111.217 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.0 p -67.1 157.68 33.01 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 70.53 -4.71 1.57 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.426 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.6 m-20 -72.28 133.01 44.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.75 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -79.53 119.84 23.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.54 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.1 m -137.06 172.41 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.68 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 5.4 m -132.71 137.55 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.368 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.773 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -97.8 120.66 38.59 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.854 -0.339 . . . . 0.0 110.535 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 39.2 mt-30 -119.0 159.68 23.41 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.416 0.627 . . . . 0.0 111.521 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.9 p -146.24 140.76 26.78 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.563 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -83.35 124.09 30.29 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.405 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.18 118.5 32.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.914 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.9 m -122.4 136.56 54.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.736 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 tt -176.0 143.84 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.781 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.3 m80 58.03 42.51 22.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.391 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 60.03 22.02 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.426 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -127.19 129.67 48.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.704 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -121.72 144.45 48.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.022 0.439 . . . . 0.0 111.18 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -155.37 175.58 13.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.806 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.9 mtmm -122.36 136.63 54.93 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.561 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.5 mt -126.51 141.28 51.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.64 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.593 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.7 t -105.08 144.8 31.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.976 0.417 . . . . 0.0 110.633 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 130' ' ' LEU . 34.7 tp -64.01 115.34 4.82 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.817 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.432 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.0 163.83 14.62 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.56 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.04 166.83 10.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.753 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.3 144.46 32.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.439 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.63 14.94 38.76 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.288 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -117.64 146.76 43.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.8 0.333 . . . . 0.0 110.693 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -135.24 14.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.538 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -84.3 9.33 13.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.629 0.252 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.59 30.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.177 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.68 139.54 38.49 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.093 0.473 . . . . 0.0 110.712 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.5 m -80.67 152.62 28.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -146.96 -163.91 1.87 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.436 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.28 140.71 49.84 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 112.203 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 . . . . . 0 CA--C 1.504 -0.82 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.673 179.598 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 21' ' ' VAL . 42.0 tp . . . . . 0 N--CA 1.458 -0.059 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.1 p -48.83 -52.65 23.02 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.432 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 31.0 pt -69.94 -15.14 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.68 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.95 -1.87 38.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.2 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.458 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.7 m -84.17 134.01 34.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 0.0 112.199 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -138.2 161.38 37.0 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.952 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.555 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.5 t -125.82 132.12 71.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.727 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.83 64.5 5.63 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.2 mm-40 -43.3 -62.83 0.94 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -178.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.434 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.6 mm-40 -124.74 164.33 20.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.744 0.783 . . . . 0.0 112.716 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.3 t -156.29 84.08 0.99 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.387 -1.279 . . . . 0.0 108.888 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -112.99 154.94 25.67 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.397 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 81.9 p -67.68 150.21 49.01 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.527 HG12 HE21 ' A' ' 79' ' ' GLN . 43.2 t -52.69 -41.94 39.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.055 0.455 . . . . 0.0 110.274 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.9 ttp85 -59.98 -51.44 69.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.13 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.65 91.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.745 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.5 tp -64.18 -44.17 92.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.862 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.527 HE21 HG12 ' A' ' 75' ' ' VAL . 44.8 mt-30 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 120.964 0.411 . . . . 0.0 110.469 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.795 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.795 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.5 mttt -88.18 -52.02 5.46 Favored 'General case' 0 C--N 1.352 0.684 0 CA-C-N 120.431 1.469 . . . . 0.0 111.529 -3.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -65.85 -28.76 69.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.033 -1.44 . . . . 0.0 113.071 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 75.7 mmtt -59.51 -48.96 79.62 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.139 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.643 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 74.3 t80 -73.96 -39.53 63.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.564 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.5 ttm -59.87 -38.09 81.2 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.573 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.17 -46.93 30.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.675 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -58.01 -43.83 86.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 62.9 m -72.07 -45.72 59.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.49 -56.56 18.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.288 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.265 -179.842 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 121.138 0.494 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.452 HG23 ' HB3' ' A' ' 13' ' ' PHE . 88.8 m -71.28 146.36 48.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.348 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.39 133.31 35.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.419 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.56 142.31 47.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.994 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -63.25 124.45 21.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.132 0.491 . . . . 0.0 110.484 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.94 -13.64 41.21 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.887 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.48 141.31 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.993 0.425 . . . . 0.0 111.328 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.25 128.45 34.2 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.3 pt -113.01 159.36 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.579 0.704 . . . . 0.0 112.833 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.434 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.42 109.29 17.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.834 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -97.5 116.86 30.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.696 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.555 ' NH2' HG21 ' A' ' 68' ' ' VAL . 61.8 ttp85 -102.67 116.51 32.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.706 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 19.5 t-80 -59.88 106.78 0.53 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.458 ' OG ' HG22 ' A' ' 66' ' ' THR . 41.5 m -52.06 -43.45 63.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -176.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.47 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 56.4 t80 -66.0 -58.67 5.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.0 m -79.12 -13.3 59.82 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . 0.447 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 72.18 -0.85 37.13 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.307 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.2 mtt -83.24 -165.47 1.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -133.94 139.0 45.84 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 37' ' ' LEU . 23.5 tp -55.77 124.95 19.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.1 t -133.36 148.08 51.84 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -176.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -94.19 98.76 11.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.1 mt -76.91 147.34 37.06 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.578 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -78.89 6.22 9.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.911 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.9 p -92.2 124.1 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.879 -179.841 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.446 -0.666 0 CA-C-O 121.048 0.451 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.7 m-85 -99.87 171.09 8.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.272 178.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -90.17 143.59 26.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.031 0.443 . . . . 0.0 109.935 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.21 116.0 51.38 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.311 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.64 -151.75 6.61 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.91 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 46.3 mt -113.51 149.14 34.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -140.38 140.06 35.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.69 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -74.17 -49.4 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.551 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.01 143.85 30.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.834 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.5 p -106.47 -7.81 17.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.707 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.3 p -52.88 114.96 1.6 Allowed 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.636 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.75 -157.04 19.67 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.712 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.503 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -120.16 -13.9 8.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.759 0.314 . . . . 0.0 111.338 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 68.4 m -90.63 8.05 36.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -110.84 132.58 54.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.042 0.449 . . . . 0.0 111.241 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.453 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.4 m95 -127.03 116.23 20.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.721 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.3 p -78.3 125.18 28.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.476 HD12 HG21 ' A' ' 175' ' ' VAL . 3.7 pt -86.92 136.66 22.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.844 0.354 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.5 m80 -128.58 149.04 70.76 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.095 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.645 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 33.9 Cg_endo -65.31 137.07 49.93 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.455 2.103 . . . . 0.0 112.511 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.408 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -78.22 -40.1 38.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.426 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 78.4 p -105.95 -171.21 1.86 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.406 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -95.03 -7.25 40.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.408 ' NE2' ' N ' ' A' ' 168' ' ' GLN . 1.7 mp0 -72.99 -32.39 65.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.022 0.439 . . . . 0.0 110.883 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.645 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.2 mmp_? -90.25 146.66 24.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.499 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.2 m -130.15 167.22 18.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.126 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -66.77 128.79 37.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.337 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 96.11 -13.55 65.76 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -70.55 156.39 39.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.045 0.45 . . . . 0.0 111.283 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.409 ' HD3' ' CZ ' ' A' ' 13' ' ' PHE . 34.9 mttp -73.91 139.67 45.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.456 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.476 HG21 HD12 ' A' ' 162' ' ' ILE . 93.1 t -89.7 119.53 36.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.213 179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . 0.422 ' HD3' ' CD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -83.8 153.71 23.93 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 121.246 0.546 . . . . 0.0 111.516 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 13.6 t -68.6 118.31 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.67 -8.01 29.97 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.276 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.14 136.34 44.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.79 0.329 . . . . 0.0 110.802 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 38.6 m-20 -76.98 114.2 15.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.414 HD21 HG13 ' A' ' 175' ' ' VAL . 64.4 mt -99.64 149.25 23.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.755 0.788 . . . . 0.0 112.955 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.493 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 66.3 mt -114.62 112.17 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 176.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -91.8 139.44 30.67 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.089 0.471 . . . . 0.0 112.156 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.46 HG22 ' CD1' ' A' ' 191' ' ' TYR . 72.7 t -131.88 121.74 47.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.902 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 95.6 p -61.42 120.27 10.15 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.503 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 91.7 t -63.38 -34.03 64.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.319 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.6 p -77.73 -39.33 44.84 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.7 m -113.71 7.39 17.18 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.39 31.29 1.24 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.461 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 22.1 mtt180 -112.7 140.65 47.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.96 0.409 . . . . 0.0 110.812 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 50.8 m-85 -72.91 152.97 41.2 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.428 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 37.4 tp -74.92 77.56 2.16 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 175.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -77.5 150.61 34.84 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -174.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.0 tp -100.43 117.81 35.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.589 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 43.0 t -111.32 145.7 38.36 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.45 90.17 3.33 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.524 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.37 -175.55 45.49 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.432 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' A' ' 197' ' ' GLY . 9.9 m120 1.16 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.449 0.7 . . . . 0.0 112.459 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 77.3 p -146.13 10.62 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.153 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 67.3 p -125.23 -177.88 4.02 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.992 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.6 m95 -108.23 137.3 46.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 111.206 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.462 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 26.4 m-70 -129.22 172.47 11.42 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.027 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.54 134.7 65.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.246 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -153.06 170.93 19.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.509 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.06 94.47 6.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.82 178.18 4.38 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.402 -177.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -86.41 10.97 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -119.5 136.83 54.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 209' ' ' GLN . 20.4 mt-30 -65.07 176.3 1.31 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 122.399 1.095 . . . . 0.0 113.143 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.5 m -169.28 120.43 0.72 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 112.946 -1.933 . . . . 0.0 107.729 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 22.4 mt -74.6 127.58 33.44 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.041 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.428 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.7 m95 -114.34 141.82 47.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.733 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.3 t -108.87 100.44 9.65 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.524 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.773 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.8 t -91.82 102.13 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.682 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.87 141.96 27.65 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.233 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.403 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.76 104.46 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.033 1.822 . . . . 0.0 111.316 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.54 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.202 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 . . . . . 0 CA--C 1.519 -0.249 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 34.4 mt -79.58 122.32 26.35 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.8 mmm180 -110.17 157.3 19.54 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.018 0.437 . . . . 0.0 111.272 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.6 p -67.79 155.22 39.82 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.889 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.66 -7.89 1.49 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.624 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 69' ' ' LEU . 5.1 m-20 -69.15 137.94 53.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.767 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -84.39 119.38 25.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.0 m -136.15 170.03 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.699 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.4 m -132.14 139.65 49.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.414 176.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.799 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -100.58 119.72 38.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.7 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 43.6 mt-30 -117.6 163.34 16.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 121.298 0.57 . . . . 0.0 111.374 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.25 144.24 25.46 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.2 m -87.41 123.29 32.2 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.621 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.576 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.04 121.18 42.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.885 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.5 m -124.73 132.91 53.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.714 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.3 tt -172.0 148.88 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.644 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.3 m80 58.75 41.44 21.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.43 21.93 11.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.39 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -126.34 150.12 48.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.534 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -135.38 146.47 48.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.91 0.386 . . . . 0.0 110.839 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.601 ' NE2' HD21 ' A' ' 35' ' ' LEU . 9.1 pt20 -158.37 172.01 19.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.763 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -118.7 137.09 53.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.534 178.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.601 HD21 ' NE2' ' A' ' 33' ' ' GLN . 2.2 mt -127.37 140.75 51.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.746 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 53.6 t -104.47 146.97 28.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.926 0.393 . . . . 0.0 110.259 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.9 tp -66.57 112.23 4.03 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.799 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.48 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.32 163.72 13.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.436 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.433 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -167.01 162.72 15.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.912 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.71 144.02 45.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.68 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.55 18.81 31.76 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.167 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -124.33 146.57 48.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.841 0.353 . . . . 0.0 110.607 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.15 -137.65 18.78 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.434 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -80.89 7.76 9.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.655 0.264 . . . . 0.0 110.922 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.18 32.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.046 179.669 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.1 mt -78.72 135.43 37.15 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.982 0.42 . . . . 0.0 110.693 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -75.57 150.35 38.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.569 0.699 . . . . 0.0 111.33 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -144.39 -165.84 2.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.502 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 37' ' ' LEU . 35.0 mt -129.99 143.6 50.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.395 0.617 . . . . 0.0 112.238 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.504 -0.813 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.674 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.633 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp . . . . . 0 CA--C 1.526 0.034 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.9 m -48.43 -49.64 34.38 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.48 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.7 pt -72.67 -16.92 18.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.856 -179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.699 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -99.09 -1.07 40.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.409 -178.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 ' OG ' ' A' ' 124' ' ' SER . 31.3 m -86.18 132.2 34.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 112.187 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -136.41 161.51 35.62 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.043 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.575 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.41 133.66 68.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.751 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 121' ' ' LEU . 17.9 mt -82.34 65.59 7.55 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.4 mm-40 -44.42 -63.91 0.79 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.4 mm100 -123.78 164.74 18.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.69 0.757 . . . . 0.0 112.742 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.21 86.98 1.03 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.068 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.2 mt -113.73 156.08 24.44 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.138 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.8 t -69.19 149.35 48.69 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.474 HG12 ' NE2' ' A' ' 79' ' ' GLN . 49.6 t -51.34 -44.4 31.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.074 0.464 . . . . 0.0 110.361 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.4 ttp-105 -56.99 -57.04 14.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.985 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.14 -43.17 87.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.633 -179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.36 -48.02 83.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.076 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.474 ' NE2' HG12 ' A' ' 75' ' ' VAL . 44.8 mt-30 . . . . . 0 C--N 1.323 -0.578 0 CA-C-O 121.007 0.432 . . . . 0.0 110.584 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.768 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 25.1 mm-40 . . . . . 0 CA--C 1.534 0.355 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.723 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.712 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 16.6 ptpt -86.66 -49.63 7.37 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.21 1.404 . . . . 0.0 111.304 -3.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -54.19 -41.48 68.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.854 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 66.1 tttp -59.56 -31.07 69.08 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.95 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.768 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.1 t80 -73.3 -44.94 58.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.43 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 68.1 mmm -56.79 -46.96 81.21 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.07 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 57.2 ttp -68.84 -42.82 76.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.336 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -57.68 -45.8 85.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.849 0.356 . . . . 0.0 110.856 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 36.5 m -68.54 -43.54 76.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.846 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.59 72.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.859 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.83 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 121.095 0.474 . . . . 0.0 111.315 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 80.9 m -74.25 147.18 42.65 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.53 130.48 35.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -114.95 141.66 47.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.159 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.94 125.4 23.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 105.17 -12.28 48.49 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.121 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.41 142.29 32.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.081 0.467 . . . . 0.0 111.237 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.92 126.41 32.45 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.5 pt -112.19 159.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.449 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 19.1 tp -114.38 109.24 18.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.877 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.441 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.11 116.22 28.92 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.779 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.575 ' NH2' HG21 ' A' ' 68' ' ' VAL . 58.7 ttp85 -101.86 116.5 32.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.715 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.4 t-80 -59.8 106.22 0.46 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.465 ' OG ' HG22 ' A' ' 66' ' ' THR . 62.0 m -49.18 -46.5 45.6 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 63.3 t80 -64.06 -64.26 0.94 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.401 ' HG ' ' CE1' ' A' ' 123' ' ' HIS . 14.7 m -72.69 -14.79 61.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.1 -1.45 40.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.179 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 49.3 mtt -82.01 -165.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.525 0.203 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 66.6 m-85 -134.6 138.69 44.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.484 HD13 HD21 ' A' ' 37' ' ' LEU . 25.1 tp -54.99 126.14 23.34 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.4 t -134.71 147.77 50.15 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.0 t -95.48 98.12 10.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.0 mt -75.02 149.54 39.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -80.84 5.96 14.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.783 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.8 p -90.32 122.83 33.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.737 0.303 . . . . 0.0 111.074 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.8 179.845 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.242 0.544 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.54 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -100.83 170.79 8.08 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.166 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -89.43 143.76 26.57 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 120.995 0.426 . . . . 0.0 109.949 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.4 t -113.49 118.0 56.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.312 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.48 -148.43 5.51 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.98 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.455 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 52.2 mt -115.92 151.29 35.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.077 0.465 . . . . 0.0 110.831 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -141.15 139.94 34.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.579 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -73.35 -52.87 12.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -82.57 147.05 28.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 58.2 p -105.49 -5.03 20.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -55.74 113.08 1.33 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.453 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.47 -159.61 21.45 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.593 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 36.5 mt-10 -118.79 -13.26 9.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.808 0.337 . . . . 0.0 111.428 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.94 -32.88 66.44 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 64.9 m -91.17 7.19 41.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.19 133.98 52.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.016 0.436 . . . . 0.0 111.253 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.44 ' O ' HG12 ' A' ' 119' ' ' ILE . 57.3 m95 -128.8 117.72 21.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.822 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.433 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 13.6 p -79.08 125.65 29.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.112 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.01 136.11 23.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.94 0.4 . . . . 0.0 110.943 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.9 m80 -128.76 151.41 77.15 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.305 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.704 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.1 Cg_endo -67.51 140.93 53.81 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.598 2.199 . . . . 0.0 112.274 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -44.52 53.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.847 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -110.8 -170.85 1.72 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.248 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.534 ' HE3' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -92.44 9.26 35.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.149 -179.819 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.534 HE22 ' HE3' ' A' ' 167' ' ' LYS . 9.9 mm-40 -83.03 -35.25 25.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.548 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.704 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 77.3 mmt-85 -91.96 146.56 23.64 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.299 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 46.1 t -123.95 165.52 17.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.398 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.18 129.46 40.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.23 -13.53 64.54 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.851 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.49 156.09 39.83 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.401 ' HG2' HG21 ' A' ' 112' ' ' THR . 37.6 mttp -72.81 140.51 47.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.473 HG21 HD12 ' A' ' 162' ' ' ILE . 93.4 t -90.25 120.06 38.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.534 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -83.85 155.64 22.83 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 121.344 0.593 . . . . 0.0 111.533 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.429 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.0 t -71.13 120.33 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.08 -11.69 31.67 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.167 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -70.67 129.82 40.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.742 0.306 . . . . 0.0 110.907 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.578 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.5 m-20 -71.41 114.81 9.87 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.409 HD21 HG13 ' A' ' 175' ' ' VAL . 69.2 mt -100.43 148.11 25.11 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 50.7 mt -113.64 113.39 43.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -93.12 137.1 32.77 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.167 0.508 . . . . 0.0 112.107 -178.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.436 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.7 t -129.14 121.1 53.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 86.5 p -61.31 124.19 19.9 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.6 t -67.81 -32.25 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.172 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 98.2 p -77.52 -37.75 50.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.5 m -116.58 6.94 13.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.55 31.39 1.33 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.4 mtt85 -111.8 143.69 42.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.827 0.346 . . . . 0.0 110.862 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.5 m-85 -74.87 154.01 38.41 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -76.14 76.05 2.98 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.6 t60 -76.54 149.64 36.65 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -174.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.2 tp -98.75 119.09 36.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.966 -1.47 . . . . 0.0 107.614 176.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 44.5 t -113.07 146.74 38.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -105.46 92.67 4.29 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.497 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -76.03 -170.31 29.62 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.541 ' ND2' ' H ' ' A' ' 199' ' ' SER . 3.3 p-10 -11.22 -67.57 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.439 0.695 . . . . 0.0 112.812 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.541 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 56.9 m -153.22 12.41 0.48 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 0.0 109.89 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 51.7 m -128.4 -179.8 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.576 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.8 m95 -106.5 135.31 48.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 111.245 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.495 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 21.1 m-70 -127.53 173.54 9.78 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.916 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -129.06 128.49 67.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.236 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -144.94 172.09 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.746 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.99 95.98 7.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.39 -179.98 3.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.323 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -88.3 10.21 20.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.903 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 25.1 mt-30 -117.87 137.13 52.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.575 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.27 175.7 2.57 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.341 1.067 . . . . 0.0 113.039 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.5 m -168.76 121.65 0.82 Allowed 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.065 -1.88 . . . . 0.0 107.748 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.6 mt -74.33 130.55 39.9 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.837 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.437 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.2 m95 -118.44 125.32 49.69 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 121.416 0.627 . . . . 0.0 111.343 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.6 m -91.08 101.11 13.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.157 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.799 HG22 ' HG ' ' A' ' 22' ' ' LEU . 98.1 t -93.57 103.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.765 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.82 142.24 28.05 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.218 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.447 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.5 Cg_exo -63.6 104.23 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.218 1.946 . . . . 0.0 111.265 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.296 -0.859 . . . . 0.0 111.167 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 . . . . . 0 CA--C 1.517 -0.291 0 CA-C-O 120.93 0.395 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.28 123.18 27.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -109.49 157.08 19.34 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.016 0.436 . . . . 0.0 111.296 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 6.1 p -67.79 156.08 37.84 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.66 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.15 -9.18 1.18 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.771 -179.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.5 m-20 -67.88 132.61 47.68 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -79.47 122.28 26.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.568 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.1 m -138.26 171.44 15.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.567 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -132.71 136.49 55.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.163 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.76 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.9 mp -97.16 123.87 41.06 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.556 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' NE2' ' HE2' ' A' ' 34' ' ' LYS . 35.0 mt-30 -124.78 145.99 49.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.714 0.769 . . . . 0.0 112.326 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.3 p -132.88 143.64 49.65 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.711 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -86.88 120.23 27.94 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.992 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.609 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -109.81 119.2 38.62 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.372 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.3 m -123.66 141.73 51.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.345 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' ND1' ' A' ' 29' ' ' HIS . 21.2 tt -170.65 140.03 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.86 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.473 ' ND1' HG12 ' A' ' 28' ' ' ILE . 3.6 p-80 38.46 58.4 1.62 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.517 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 6.5 mmmm 58.27 35.61 25.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.965 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -139.0 113.78 9.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -117.95 148.07 42.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.461 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -163.01 173.54 13.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.549 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE2' ' NE2' ' A' ' 23' ' ' GLN . 39.1 mtpt -118.56 136.84 53.63 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.668 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.5 mt -127.98 142.08 51.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.324 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.7 p -105.66 142.12 35.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.072 0.463 . . . . 0.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -63.71 112.9 3.06 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.047 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.469 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.49 164.07 13.72 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.581 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.9 165.0 14.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.597 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -139.44 146.4 40.04 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.656 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.15 10.84 59.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -121.29 153.58 37.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.743 0.306 . . . . 0.0 110.658 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.7 -135.89 15.07 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.318 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -87.13 8.21 24.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.658 0.266 . . . . 0.0 110.87 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.14 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.651 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 55.6 mt -80.32 140.44 36.14 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.773 0.32 . . . . 0.0 110.544 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.629 ' SG ' HG13 ' A' ' 203' ' ' VAL . 29.6 p -81.05 150.9 28.64 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 111.112 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -144.4 -166.47 2.39 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.838 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 48.3 mt -130.47 144.93 51.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.335 0.588 . . . . 0.0 112.208 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.9 mt-10 . . . . . 0 CA--C 1.503 -0.849 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.604 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 HG11 ' A' ' 21' ' ' VAL . 48.5 tp . . . . . 0 N--CA 1.457 -0.109 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.6 m -51.83 -46.78 64.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.268 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.469 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.3 pt -70.68 -18.72 21.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 32.5 m -99.9 12.33 37.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.716 0.293 . . . . 0.0 111.073 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -90.14 129.35 36.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 111.841 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -136.17 161.22 36.33 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.148 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.572 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.27 132.21 71.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.612 178.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.8 mt -80.84 65.81 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.507 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 13.2 mm-40 -44.67 -66.9 0.33 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.483 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -121.25 164.24 17.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.611 0.719 . . . . 0.0 112.895 -177.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -154.76 86.55 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.285 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 mt -113.91 154.47 27.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.387 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.2 t -68.58 146.25 53.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.0 t -45.86 -49.08 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.187 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -52.6 -53.84 41.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.926 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.77 -53.48 57.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.0 tp -51.49 -45.41 62.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.237 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 120.947 0.403 . . . . 0.0 110.284 179.646 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.803 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.7 mm-40 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.76 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.763 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 95.3 mttt -86.03 -50.43 7.05 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 120.13 1.332 . . . . 0.0 111.409 -2.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -54.45 -44.14 72.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.057 -177.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 98.8 mttt -56.07 -34.94 66.43 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.356 -179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.803 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -73.84 -42.48 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.705 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 56.1 tpp -57.33 -41.25 79.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.543 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 54.2 ttp -73.12 -43.03 62.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.554 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.9 ttmp? -58.05 -42.59 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.055 0.455 . . . . 0.0 110.307 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.0 m -72.58 -40.43 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.9 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.86 -39.19 84.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.091 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.587 179.858 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 15.0 ptm180 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 121.138 0.494 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.4 m -72.65 147.45 45.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.196 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.55 129.58 34.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.695 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -113.03 143.6 44.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.374 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.503 ' HD2' ' HG2' ' A' ' 173' ' ' GLU . 38.0 m-85 -62.66 143.9 56.86 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.115 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 86.07 -14.99 51.41 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.557 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.496 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.5 OUTLIER -79.81 141.98 35.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.138 0.494 . . . . 0.0 111.611 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.54 127.18 33.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.226 177.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.9 pt -112.0 162.62 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.575 0.702 . . . . 0.0 112.855 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.483 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.2 tp -117.36 109.95 17.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.96 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.1 mt -98.02 116.25 29.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.767 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.572 ' NH2' HG21 ' A' ' 68' ' ' VAL . 57.9 ttp85 -102.83 116.8 33.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.787 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.9 t-80 -59.39 107.1 0.52 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.6 t -48.66 -50.26 33.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.457 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.5 t80 -61.49 -66.67 0.5 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.422 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.9 p -67.41 -21.36 65.59 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.4 -2.01 68.69 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.157 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -83.06 -165.61 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.465 0.174 . . . . 0.0 110.659 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.3 m-85 -134.03 139.66 46.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.6 tp -55.55 125.31 20.45 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.7 t -133.84 148.23 51.28 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 50.5 t -95.07 98.13 10.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.513 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.67 155.75 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.263 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.8 t -86.43 6.61 29.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.943 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.8 p -92.32 124.21 36.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.655 0.264 . . . . 0.0 111.081 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 0.0 110.806 179.917 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.31 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.4 m-85 -104.79 176.07 5.28 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.433 177.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.41 141.75 28.22 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.593 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 59.9 t -111.21 125.87 68.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -141.41 -151.58 5.58 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.562 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 76.8 mt -115.77 143.94 44.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.042 0.448 . . . . 0.0 110.841 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -133.69 141.07 47.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.932 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.14 -64.02 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.54 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.89 149.1 36.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.716 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.1 p -103.46 1.32 32.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.948 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.2 p -55.69 114.46 1.88 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.73 -161.29 18.13 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.606 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.0 mt-10 -118.2 -11.38 10.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.75 0.31 . . . . 0.0 111.146 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.83 66.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.04 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.4 m -90.21 7.66 37.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.722 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -111.17 132.03 54.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.399 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.476 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.9 m95 -127.28 116.42 20.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.676 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 12.8 p -78.85 125.24 29.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.152 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.03 137.07 21.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.818 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 69.8 m80 -130.8 149.21 73.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.264 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.615 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 23.7 Cg_endo -64.36 137.76 57.27 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.323 2.015 . . . . 0.0 112.244 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.1 49.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.742 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 68.6 m -113.15 -167.61 1.21 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 167' ' ' LYS . 8.1 tmtm? -91.41 1.48 57.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.78 -26.53 34.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.615 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 14.6 mmp_? -94.14 145.67 24.53 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.478 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 173' ' ' GLU . 69.4 m -111.63 152.63 27.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.047 -178.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . 0.523 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.1 OUTLIER -71.72 132.11 44.07 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 79.77 -4.53 64.87 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.541 ' HB3' ' O ' ' A' ' 170' ' ' SER . 0.0 OUTLIER -79.16 154.8 29.02 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.66 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 173' ' ' GLU . 81.5 mttt -59.05 138.32 57.59 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.225 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 90.1 t -93.75 116.93 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.104 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . 0.432 ' HB2' ' OD2' ' A' ' 179' ' ' ASP . 11.1 mpt_? -80.03 154.01 28.45 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.177 0.513 . . . . 0.0 111.519 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 42.2 t -68.73 122.53 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 176.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.75 -13.5 35.13 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.23 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 169' ' ' ARG . 71.1 m-20 -68.36 129.1 38.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.79 0.329 . . . . 0.0 110.719 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -71.86 112.81 8.28 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.442 HD21 HG13 ' A' ' 175' ' ' VAL . 65.2 mt -97.29 150.66 20.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.834 0.826 . . . . 0.0 113.158 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.413 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 43.9 mt -115.21 113.97 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 176.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.99 135.01 35.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.001 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.456 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.0 t -127.55 122.06 58.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.933 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 29.5 t -62.23 122.03 14.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -67.08 -30.86 50.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.025 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.49 -40.0 36.64 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.9 m -115.13 7.78 15.47 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.56 31.63 1.4 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 190' ' ' ARG . 4.9 mtt-85 -113.13 142.26 45.96 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -73.54 153.33 40.32 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.5 tp -75.12 76.33 2.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 175.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.496 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.2 t60 -76.32 151.29 36.73 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.93 115.19 29.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 113.604 -1.634 . . . . 0.0 107.731 177.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 67.7 m -107.86 147.46 30.91 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -106.72 92.26 4.03 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.512 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.47 -173.46 39.75 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.341 -0.933 . . . . 0.0 111.594 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' A' ' 197' ' ' GLY . 10.5 p-10 -5.55 -71.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.415 ' H ' ' CG ' ' A' ' 198' ' ' ASN . 54.3 m -151.97 13.83 0.61 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 31.2 t -127.86 -179.33 4.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.742 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.609 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.3 m95 -108.08 134.99 50.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.223 0.535 . . . . 0.0 111.321 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.484 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 20.4 m-70 -127.51 177.96 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.942 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . 0.629 HG13 ' SG ' ' A' ' 47' ' ' CYS . 3.0 p -132.36 130.2 60.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.47 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 54.7 p-10 -146.56 173.97 11.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.632 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.06 91.76 4.93 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -110.43 -179.51 3.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -87.73 5.03 41.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.484 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.496 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 65.8 mt-30 -112.99 137.95 50.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.635 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -64.86 175.23 1.56 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 122.35 1.072 . . . . 0.0 112.852 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.8 m -168.17 119.96 0.83 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 112.997 -1.911 . . . . 0.0 107.846 178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 25.1 mt -74.56 129.34 37.56 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.436 -0.505 . . . . 0.0 109.996 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 99.0 m95 -116.42 145.43 43.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.521 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -112.47 99.86 8.31 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.345 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.76 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.5 t -91.46 99.98 10.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.573 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.63 140.47 23.92 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.3 Cg_exo -62.36 103.97 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.097 1.865 . . . . 0.0 111.141 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.568 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.6 mm . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.295 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.8 mt -82.85 118.74 23.64 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.6 mmm180 -107.36 158.13 17.4 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.242 0.544 . . . . 0.0 111.342 -179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -68.41 154.44 41.81 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 72.46 -2.91 2.47 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.786 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.436 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.1 m-20 -73.82 138.44 44.45 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.741 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -84.34 121.18 27.17 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.554 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.7 m -137.5 169.73 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.7 137.04 56.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 114.678 -1.147 . . . . 0.0 108.277 176.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.745 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.3 mp -97.8 123.91 41.96 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.614 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.4 mt-30 -124.56 146.75 48.85 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.544 0.688 . . . . 0.0 112.194 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.23 143.67 49.28 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.746 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 m -86.56 120.48 27.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.213 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.62 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.74 121.09 44.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.179 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.8 m -125.75 133.13 52.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.004 0.43 . . . . 0.0 111.775 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.476 HG23 ' CD2' ' A' ' 29' ' ' HIS . 16.9 tt -169.85 146.56 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.382 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.476 ' CD2' HG23 ' A' ' 28' ' ' ILE . 37.1 m-70 57.68 43.7 21.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.02 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.8 OUTLIER 58.91 23.57 11.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.364 179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.03 144.12 50.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.371 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -132.0 147.6 52.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.917 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -161.35 171.13 18.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 21.6 mtpp -118.85 139.12 52.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.381 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HA ' ' O ' ' A' ' 50' ' ' GLU . 1.5 mt -127.9 144.24 51.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.303 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.6 p -108.37 139.83 42.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 0.0 110.693 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.1 tp -62.13 113.23 2.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.1 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.37 168.3 9.97 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.597 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -172.74 165.34 5.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.66 150.97 48.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.511 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.26 -0.35 88.58 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.816 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -113.96 153.87 28.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.868 0.366 . . . . 0.0 111.056 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.38 -128.24 8.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.523 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.0 t-20 -91.31 3.87 53.78 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.749 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 43.12 28.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.584 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 mt -81.31 133.87 35.5 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.418 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.7 m -72.63 150.2 43.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -145.94 -170.39 3.47 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.503 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.489 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.1 mt -129.17 143.28 50.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.497 0.665 . . . . 0.0 112.45 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.4 mt-10 . . . . . 0 CA--C 1.502 -0.879 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.765 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp . . . . . 0 C--O 1.231 0.126 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.0 m -52.28 -50.22 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 29.8 pt -68.6 -17.34 22.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 51.4 m -100.27 11.4 39.47 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.826 0.346 . . . . 0.0 111.03 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -90.22 130.11 36.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.11 0.481 . . . . 0.0 111.689 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -136.45 160.83 37.58 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.102 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.3 t -124.83 132.57 71.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.863 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.436 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.6 mt -80.9 64.33 5.62 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.523 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.6 mm-40 -43.5 -64.02 0.73 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.465 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.5 mm100 -123.18 162.93 21.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.707 0.765 . . . . 0.0 112.888 -177.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.6 m -154.13 84.9 1.14 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.987 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 mt -113.18 154.19 27.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.187 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.54 ' HB3' HH12 ' A' ' 76' ' ' ARG . 47.4 t -67.76 149.1 50.37 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 48.5 t -49.94 -43.86 20.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.88 0.371 . . . . 0.0 110.276 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.54 HH12 ' HB3' ' A' ' 74' ' ' SER . 1.9 tmm_? -58.7 -52.94 63.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.22 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.421 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -59.51 -44.11 93.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.702 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.9 tp -62.24 -48.06 81.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.345 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 120.816 0.341 . . . . 0.0 110.543 179.851 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.689 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.8 mm-40 . . . . . 0 CA--C 1.531 0.25 0 CA-C-O 119.164 -0.446 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.652 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 25.1 tptp -87.75 -38.2 15.98 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 124.5 1.12 . . . . 0.0 109.942 -4.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -53.62 -44.64 69.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.697 -178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -61.69 -27.7 68.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.211 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.689 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 66.4 t80 -74.25 -49.44 23.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.501 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 58.6 ttp -60.66 -38.84 86.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.846 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.1 mtp -72.13 -45.4 60.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.014 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -59.15 -41.07 87.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.837 0.351 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 55.2 p -71.91 -43.81 64.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.91 -29.59 70.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.797 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 . . . . . 0 CA--C 1.527 0.078 0 CA-C-O 121.373 0.606 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.4 m -81.49 150.55 28.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.838 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.42 130.44 35.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.734 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.5 mt -115.49 143.25 45.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.142 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -63.97 129.68 41.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.039 0.447 . . . . 0.0 110.49 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.43 -11.71 58.25 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.944 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.01 141.09 31.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.091 0.472 . . . . 0.0 111.388 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.02 127.18 33.33 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 160' ' ' TRP . 40.5 pt -110.99 163.52 7.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.541 0.686 . . . . 0.0 112.602 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.465 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.5 tp -118.81 108.46 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.752 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.417 ' CD2' HD23 ' A' ' 69' ' ' LEU . 57.7 mt -96.75 117.47 31.11 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.739 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.523 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 18.9 ttp180 -104.02 116.69 32.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.553 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.45 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.8 t-80 -59.82 106.68 0.51 Allowed 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.7 t -49.83 -45.31 50.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 31.8 t80 -67.01 -59.88 3.11 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.9 m -74.72 -14.74 60.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.26 -2.84 26.05 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.376 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . 0.428 ' HB2' ' HB3' ' A' ' 149' ' ' LEU . 50.1 mtt -82.95 -165.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.4 m-85 -132.94 138.9 47.07 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.2 tp -54.78 126.03 22.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.579 ' SG ' HD21 ' A' ' 133' ' ' LEU . 16.7 p -136.34 148.66 48.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.3 t -94.82 97.4 10.01 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.726 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.579 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.0 mt -72.89 154.86 40.4 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.458 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -83.0 2.31 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.186 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.5 p -95.74 120.97 36.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.78 0.324 . . . . 0.0 111.107 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 78.0 p . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.551 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.515 -0.377 0 CA-C-O 121.482 0.658 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.2 m-85 -100.54 170.24 8.51 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.113 177.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -89.38 145.1 25.57 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.7 t -113.89 117.14 54.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.529 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.23 -151.54 6.45 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.987 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.9 mt -115.71 141.72 47.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.423 . . . . 0.0 110.731 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.498 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -130.92 140.72 50.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.695 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.86 -69.01 0.37 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.585 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.96 148.41 46.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.685 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.0 p -104.21 0.16 29.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.127 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -55.54 112.77 1.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.436 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.17 -160.22 20.57 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.672 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.482 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 32.0 mt-10 -118.95 -10.73 9.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.98 -33.13 66.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 82.5 m -91.84 9.69 31.74 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.18 132.5 54.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 0.0 111.353 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.463 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -128.44 116.66 20.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.728 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 15.5 p -78.6 126.73 31.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.252 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.496 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.93 136.77 22.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.879 0.371 . . . . 0.0 110.887 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -130.77 150.3 76.06 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.315 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.719 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 39.5 Cg_endo -66.49 141.01 59.52 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.664 2.242 . . . . 0.0 112.295 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.52 -46.31 48.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.78 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 21.3 t -113.61 -177.23 3.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.126 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.494 ' HD2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -85.31 15.23 4.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.281 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.494 HE22 ' HD2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -85.89 -36.25 20.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.196 0.522 . . . . 0.0 110.2 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.719 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.8 mmp_? -93.89 148.23 22.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.061 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 49.1 m -125.12 166.71 15.93 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.234 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.47 133.44 50.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.186 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 90.83 -12.07 69.95 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.302 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.8 mt-10 -72.42 154.6 40.8 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 120.999 0.428 . . . . 0.0 111.183 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -70.42 142.44 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.496 HG21 HD12 ' A' ' 162' ' ' ILE . 85.8 t -92.48 111.88 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.588 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 155.29 38.09 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 121.435 0.636 . . . . 0.0 111.49 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.403 HG13 ' HD3' ' A' ' 216' ' ' PRO . 41.5 t -71.37 120.41 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.2 -12.37 33.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.261 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.778 0.323 . . . . 0.0 110.859 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.502 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.1 m-20 -69.93 110.65 5.14 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.487 HD21 HG13 ' A' ' 175' ' ' VAL . 70.2 mt -97.28 148.89 22.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.783 0.801 . . . . 0.0 113.088 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 209' ' ' GLN . 52.6 mt -114.16 113.18 43.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.5 mp -93.34 137.51 32.58 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.0 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.5 t -129.19 126.85 64.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.61 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.2 t -66.09 127.72 33.25 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 99.5 t -71.22 -32.12 46.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.979 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -80.13 -35.69 36.34 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.5 m -116.94 4.79 12.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.42 31.8 1.39 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -113.58 141.05 47.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.019 0.437 . . . . 0.0 110.759 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 48.5 m-85 -71.5 153.71 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.41 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.23 75.61 2.36 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.08 150.36 38.88 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -174.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.3 tp -100.28 116.53 32.47 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 113.667 -1.606 . . . . 0.0 107.632 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.416 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 47.5 t -110.16 146.79 34.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -105.26 94.56 5.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.5 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -77.86 -169.51 33.81 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.961 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.9 p30 -11.54 -66.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.425 0.69 . . . . 0.0 112.714 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 53.1 m -154.62 11.92 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.193 0.52 . . . . 0.0 109.731 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 69.4 m -127.04 -178.69 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.851 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.62 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.64 135.69 48.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.167 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.5 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 16.9 m-70 -128.32 172.99 10.55 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.004 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.9 p -127.2 134.32 66.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.297 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.9 p30 -151.7 172.03 16.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.594 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.86 93.84 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.209 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.04 174.09 6.07 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.191 -177.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -83.08 9.35 10.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.01 135.54 54.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.678 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.51 ' NE2' HD13 ' A' ' 182' ' ' ILE . 92.4 mt-30 -65.61 175.56 1.8 Allowed 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.284 1.04 . . . . 0.0 113.028 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.9 m -168.73 122.32 0.85 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.144 -1.844 . . . . 0.0 107.936 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 55.1 mt -76.42 127.43 32.83 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.082 0.468 . . . . 0.0 109.969 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.4 m95 -114.81 146.98 40.43 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.682 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.9 t -114.15 100.8 8.65 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.163 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.745 HG22 ' HG ' ' A' ' 22' ' ' LEU . 78.4 t -92.6 102.02 13.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.74 141.04 25.43 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.113 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.418 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.86 103.41 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.129 1.886 . . . . 0.0 111.266 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.554 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 . . . . . 0 CA--C 1.519 -0.237 0 CA-C-O 120.778 0.323 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 22.2 mt -80.18 122.63 27.07 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 11.2 mmm180 -111.63 157.84 19.95 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.059 0.457 . . . . 0.0 111.215 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.44 ' HG1' ' N ' ' A' ' 111' ' ' ARG . 11.6 p -68.36 155.32 40.04 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.868 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.94 -8.37 1.29 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.639 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.7 m-20 -69.07 135.03 50.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 12.7 tt0 -80.24 119.03 22.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.53 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.1 m -135.08 171.9 16.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.676 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.05 140.89 45.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.658 -1.156 . . . . 0.0 108.473 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.765 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -101.52 121.1 41.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.689 0.281 . . . . 0.0 110.5 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -121.58 152.59 39.08 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.536 0.684 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' HD22 ' A' ' 194' ' ' LEU . 24.3 t -139.05 143.99 38.61 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.741 179.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.3 m -86.33 121.28 28.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.39 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.589 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.16 119.92 39.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.001 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.6 m -124.86 137.04 54.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.944 0.402 . . . . 0.0 111.582 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.7 tt -173.08 143.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.54 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.8 m80 58.91 37.41 24.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.877 0.37 . . . . 0.0 110.713 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.88 25.63 15.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.105 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -127.07 122.59 34.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.468 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -114.98 145.18 42.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.332 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.447 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.8 pt20 -157.63 171.15 20.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.563 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -118.56 134.83 54.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.59 178.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.6 mt -124.47 142.47 51.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.341 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 54.0 t -107.09 141.3 38.54 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.644 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 tp -61.01 113.22 2.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.992 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.458 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.15 164.74 12.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.271 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.35 162.32 10.32 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.694 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -133.18 146.7 51.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.831 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.89 3.34 85.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.788 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -114.08 152.18 31.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 110.972 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.02 -140.45 23.13 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.725 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.411 HD22 ' HB2' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -78.0 4.69 11.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.621 0.248 . . . . 0.0 111.147 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.25 31.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.158 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.411 ' HB2' HD22 ' A' ' 44' ' ' ASN . 36.3 mt -77.67 139.72 39.48 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.466 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.0 m -79.58 149.7 31.3 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.564 0.697 . . . . 0.0 111.284 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -145.18 -166.21 2.37 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.555 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.6 mt -130.47 145.21 51.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.438 0.637 . . . . 0.0 112.301 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.503 -0.851 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.769 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.596 HD11 HG11 ' A' ' 21' ' ' VAL . 47.3 tp . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -49.6 -48.14 49.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.458 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.6 pt -72.67 -17.88 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 111.467 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.676 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.69 -0.67 45.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.118 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.486 HG22 ' OG ' ' A' ' 124' ' ' SER . 28.3 m -86.2 132.77 33.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.208 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -137.4 163.08 31.92 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.889 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.544 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.6 t -126.14 133.6 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.719 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.47 HD11 HG11 ' A' ' 20' ' ' VAL . 15.9 mt -82.58 64.35 7.18 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.1 mm-40 -43.7 -61.32 1.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -178.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 11.2 mm100 -125.36 164.53 20.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 112.893 -177.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -156.64 85.08 0.97 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.893 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mt -114.9 155.44 26.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.279 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.3 p -68.6 148.52 50.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.2 t -50.03 -44.16 21.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.161 0.505 . . . . 0.0 110.235 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.0 ttp85 -57.91 -51.2 70.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.236 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.84 -43.06 99.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.706 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.83 -47.11 87.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.988 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 179.93 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.814 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 8.2 mm-40 . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.882 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 18.9 pttp -86.53 -50.53 6.78 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 120.349 1.431 . . . . 0.0 111.611 -2.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.484 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.6 t-105 -56.55 -39.24 73.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.293 -1.321 . . . . 0.0 113.135 -177.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 51.6 tttp -61.39 -33.75 74.19 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.287 -179.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.814 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 24.5 t80 -73.93 -44.8 53.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.899 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 17.6 tpt -59.37 -39.17 82.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.65 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 53.1 ttp -71.0 -47.37 59.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.849 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -59.06 -45.01 91.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.1 m -66.98 -46.96 73.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.108 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.88 72.15 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.189 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.753 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.44 ' N ' ' HG1' ' A' ' 16' ' ' THR . 15.6 ptm180 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.955 0.407 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 91.2 m -79.33 145.34 33.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.33 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.54 132.25 35.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.802 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -116.31 142.46 46.81 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.202 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -62.56 129.82 42.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.083 0.468 . . . . 0.0 110.473 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.56 -12.21 58.14 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.56 140.42 32.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.971 0.415 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.98 128.31 33.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.0 pt -112.42 158.62 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 112.747 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.1 tp -114.44 108.98 17.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.88 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.0 mt -97.35 115.6 28.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.691 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.544 ' NH2' HG21 ' A' ' 68' ' ' VAL . 64.9 ttp85 -102.22 116.42 32.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.712 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.471 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.6 t-80 -58.09 108.69 0.63 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.486 ' OG ' HG22 ' A' ' 66' ' ' THR . 67.6 m -50.3 -53.3 29.58 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.471 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.8 t80 -56.82 -69.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -63.96 -31.96 73.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 89.24 -0.54 81.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.959 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.9 mtt -83.73 -165.82 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.432 -0.21 . . . . 0.0 110.432 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.49 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.3 m-85 -133.66 138.38 45.86 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 24.8 tp -54.07 125.96 20.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 47.6 t -135.13 149.93 50.1 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 40.8 t -96.69 97.12 9.1 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.7 mt -74.0 155.93 38.08 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.483 -178.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.3 m -84.93 2.37 43.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.856 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 48.0 p -89.16 124.55 34.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.692 0.282 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.514 -0.434 0 CA-C-O 121.414 0.626 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.3 m-85 -101.9 174.28 6.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.93 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -93.65 142.55 27.22 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.54 118.68 58.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.97 5.91 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.713 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 54.3 mt -115.07 146.73 41.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.074 0.464 . . . . 0.0 110.67 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -138.72 139.72 38.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.848 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.81 -78.56 0.07 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.692 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.21 146.91 46.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.645 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 120' ' ' LEU . 74.1 p -105.13 5.42 32.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.267 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.9 p -58.35 111.69 1.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.668 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.53 -163.35 19.53 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.937 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.481 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 30.8 mt-10 -116.35 -8.81 11.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.774 0.321 . . . . 0.0 111.261 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.84 -32.13 67.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.5 p -93.41 10.27 32.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.11 131.71 54.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.1 0.476 . . . . 0.0 111.479 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.438 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.6 m95 -126.63 116.76 21.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.912 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.9 p -78.62 127.09 31.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.167 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.467 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.86 135.02 26.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.947 0.403 . . . . 0.0 110.953 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.429 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.5 m80 -127.26 149.88 70.9 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.217 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.636 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.41 138.07 49.23 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.522 2.148 . . . . 0.0 112.216 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.21 -40.3 52.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.565 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.2 p -108.63 -171.75 1.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.489 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -91.78 -8.0 47.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.203 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -71.42 -34.25 70.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.211 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 71.3 mmt-85 -89.99 146.3 24.47 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.708 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 40.8 t -129.19 168.18 16.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.976 0.417 . . . . 0.0 111.383 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.7 136.16 55.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.96 -17.3 51.85 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.293 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 170' ' ' SER . 24.1 mt-10 -67.3 155.99 37.52 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.919 0.39 . . . . 0.0 111.396 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.4 mttt -71.84 144.17 49.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.477 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.467 HG21 HD12 ' A' ' 162' ' ' ILE . 92.8 t -94.89 112.81 28.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.316 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -77.7 155.17 31.46 Favored 'General case' 0 CA--C 1.5 -0.964 0 CA-C-O 121.392 0.615 . . . . 0.0 111.471 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.413 HG13 ' HD3' ' A' ' 216' ' ' PRO . 53.0 t -69.2 121.82 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.72 -17.15 33.33 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.291 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -63.27 127.02 29.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.738 0.304 . . . . 0.0 110.824 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.6 m-20 -69.88 112.89 6.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -98.19 149.01 23.01 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.429 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 48.6 mt -113.56 113.23 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.5 136.17 33.44 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.257 0.551 . . . . 0.0 112.354 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.442 HG22 ' CD1' ' A' ' 191' ' ' TYR . 70.8 t -129.03 125.25 62.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.545 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 45.4 t -64.5 126.55 28.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.77 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.481 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -69.77 -33.93 58.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.991 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.36 -36.32 39.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 56.3 m -116.3 5.45 13.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.07 31.26 1.53 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 31.4 mtt85 -112.04 142.67 44.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.899 0.38 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.9 m-85 -74.29 153.56 39.31 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -75.86 76.82 2.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 175.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.405 ' HA ' ' OG1' ' A' ' 210' ' ' THR . 82.0 t60 -76.44 149.32 36.86 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 -174.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.569 HD22 ' SG ' ' A' ' 24' ' ' CYS . 11.4 tp -100.33 114.64 28.3 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.634 177.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.406 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 41.6 t -107.17 147.33 30.23 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -106.45 91.39 3.68 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.538 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -76.14 -174.19 37.13 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.496 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 80.3 m-20 -5.6 -75.87 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.243 0.617 . . . . 0.0 112.457 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 35.8 t -146.32 14.4 1.27 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.097 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 59.3 m -128.33 -179.83 5.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.996 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.589 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.4 m95 -107.89 135.48 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.23 0.538 . . . . 0.0 111.243 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.538 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 17.3 m-70 -128.2 174.92 8.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.881 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.7 p -129.29 133.16 66.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.35 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.77 173.07 14.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.669 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.37 96.24 7.58 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.71 -179.5 3.67 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -88.44 10.72 19.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.424 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -118.99 134.88 54.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.058 0.456 . . . . 0.0 110.72 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.31 175.09 0.6 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.364 1.078 . . . . 0.0 112.844 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . 0.41 HG23 ' SG ' ' A' ' 24' ' ' CYS . 22.8 m -168.65 119.35 0.76 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 112.979 -1.918 . . . . 0.0 107.782 178.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.7 mt -74.19 128.89 36.71 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.024 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.4 m95 -116.12 146.31 42.34 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.466 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -113.78 100.55 8.54 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.304 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.765 HG22 ' HG ' ' A' ' 22' ' ' LEU . 95.6 t -92.88 100.55 11.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.19 141.8 26.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.074 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.413 ' HD3' HG13 ' A' ' 177' ' ' VAL . 26.8 Cg_exo -62.42 103.88 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.192 1.928 . . . . 0.0 111.265 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.53 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.311 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 . . . . . 0 CA--C 1.516 -0.354 0 CA-C-O 120.723 0.297 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.92 129.58 38.18 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.3 mmt85 -117.4 157.38 26.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.098 0.475 . . . . 0.0 111.103 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 9.1 p -67.95 155.08 40.25 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.726 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.07 -7.8 1.43 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.699 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.9 m-20 -69.33 133.05 47.37 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.836 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.32 121.16 25.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.495 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 22.1 m -136.07 173.0 14.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.61 HG11 HD11 ' A' ' 62' ' ' LEU . 3.1 m -134.93 136.74 51.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.169 176.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -98.06 124.86 42.77 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.655 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 71.9 mt-30 -124.91 145.01 50.03 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 121.664 0.745 . . . . 0.0 112.295 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.7 p -131.42 146.11 52.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.882 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -88.16 123.49 32.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.627 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.37 120.03 38.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.304 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.8 m -125.17 136.51 53.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.934 0.397 . . . . 0.0 111.685 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.0 tt -173.8 143.64 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.564 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 49.0 m80 61.15 32.63 19.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.734 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mmmm 67.74 22.31 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.075 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -126.06 124.61 41.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.511 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.16 147.28 41.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.208 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -158.21 172.98 17.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -120.4 136.02 54.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -125.3 145.28 50.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.391 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 28.9 p -107.42 140.09 40.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.08 0.467 . . . . 0.0 110.622 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -62.75 111.62 2.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.072 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.69 166.05 11.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.461 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.2 163.09 15.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.31 149.94 46.14 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.66 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.1 -5.25 89.32 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.755 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -107.39 157.35 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 0.0 110.938 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -141.57 23.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.368 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -83.34 9.54 10.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.683 0.278 . . . . 0.0 110.705 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.28 29.78 0.25 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.124 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -80.01 139.41 36.99 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.819 0.342 . . . . 0.0 110.512 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 31.5 p -78.71 148.15 33.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.364 0.602 . . . . 0.0 111.031 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -141.25 -165.57 1.99 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.001 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 29.7 mt -131.97 146.22 51.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.293 0.568 . . . . 0.0 112.374 -178.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 3.8 mt-10 . . . . . 0 CA--C 1.5 -0.952 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.718 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.61 HD11 HG11 ' A' ' 21' ' ' VAL . 49.2 tp . . . . . 0 C--O 1.232 0.137 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.4 m -50.94 -44.31 60.37 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 38' ' ' ALA . 23.3 pt -73.07 -20.67 18.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 56.4 m -97.54 12.75 32.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.948 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.6 m -91.31 128.29 37.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.145 0.498 . . . . 0.0 111.729 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -136.09 161.53 35.45 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.129 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.589 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -125.46 132.43 71.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.5 mt -80.71 66.56 6.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 16.3 mm-40 -45.68 -64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.439 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.4 mm100 -122.12 163.08 20.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.705 0.764 . . . . 0.0 112.826 -177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.3 m -154.69 85.9 1.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.427 -1.26 . . . . 0.0 108.771 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.9 158.09 20.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.538 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.9 p -70.49 146.49 50.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 50.7 t -48.63 -44.25 14.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.099 0.476 . . . . 0.0 110.539 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -57.98 -53.11 61.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.3 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -43.3 96.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.769 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.4 tp -62.03 -47.54 84.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.306 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 51.9 mt-30 . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 120.728 0.299 . . . . 0.0 110.741 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.695 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 119.233 -0.413 . . . . 0.0 110.715 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.695 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 84.9 mttt -89.84 -56.02 3.4 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-O 123.229 1.49 . . . . 0.0 108.547 -5.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 101' ' ' MET . 76.4 m95 -77.06 -27.44 54.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 112.661 -2.063 . . . . 0.0 111.66 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -56.05 -58.76 6.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.895 -178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.586 ' HB3' ' HG3' ' A' ' 96' ' ' GLU . 2.5 t80 -77.26 -33.46 55.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.838 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.469 ' HB3' ' HA ' ' A' ' 98' ' ' TRP . 1.8 tmt? -56.31 -49.52 74.07 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.395 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.8 mtm -74.66 -43.41 55.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -57.15 -43.63 82.67 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.829 0.347 . . . . 0.0 110.963 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.9 m -72.58 -46.78 52.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.31 -34.46 66.54 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.366 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.003 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 20.1 ptp180 . . . . . 0 CA--C 1.526 0.042 0 CA-C-O 121.036 0.445 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.404 HG21 ' HG2' ' A' ' 174' ' ' LYS . 86.2 m -79.93 145.27 32.73 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.105 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.29 131.19 35.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.659 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -115.34 142.7 46.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.199 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -62.81 134.44 56.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.053 0.454 . . . . 0.0 110.5 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.06 -14.4 63.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.986 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -81.53 141.1 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.085 0.469 . . . . 0.0 111.361 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.72 128.41 34.34 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.156 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -113.11 160.43 12.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.638 0.732 . . . . 0.0 112.73 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.439 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.2 tp -116.52 108.82 16.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.94 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.3 mt -96.62 116.45 29.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.675 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.589 ' NH2' HG21 ' A' ' 68' ' ' VAL . 55.1 ttp85 -102.49 116.95 33.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.749 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.445 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.5 t-80 -59.2 107.6 0.57 Allowed 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 177.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 35.1 t -48.47 -54.78 12.95 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.445 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.1 t80 -56.82 -70.05 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.415 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.6 p -63.18 -28.81 70.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 86.83 -5.44 84.98 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.92 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.0 mtt -80.18 -165.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.446 0.165 . . . . 0.0 110.703 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.46 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.3 m-85 -134.02 140.21 46.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.36 126.25 24.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.0 t -135.18 148.28 49.64 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.1 t -94.83 97.92 10.38 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.32 147.37 40.21 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.0 t -78.34 2.35 18.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.587 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 40.5 p -87.97 121.67 30.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.578 179.684 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 121.534 0.683 . . . . 0.0 112.835 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -102.69 174.26 5.97 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.963 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -93.32 141.78 28.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.861 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 60.9 t -111.31 125.97 68.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -144.15 -150.69 5.3 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.757 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 66.5 mt -114.62 144.55 43.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.149 0.5 . . . . 0.0 110.969 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -137.29 137.95 39.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.677 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.45 -76.15 0.08 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.48 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -63.89 146.46 53.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.7 p -103.33 -0.66 29.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.035 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.8 p -54.97 112.26 1.01 Allowed 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.411 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 130.12 -161.55 23.08 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.52 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -118.68 -15.25 9.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 0.0 111.493 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.25 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.1 m -88.05 5.45 40.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.62 0.248 . . . . 0.0 111.613 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -110.88 132.69 53.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.103 0.478 . . . . 0.0 111.261 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.458 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.5 m95 -127.34 117.77 22.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.704 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.404 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 11.2 p -79.26 126.46 30.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.111 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.498 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.5 135.13 26.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.932 0.396 . . . . 0.0 110.976 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.436 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.9 m80 -127.71 151.65 75.71 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.209 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.728 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.7 Cg_endo -68.07 140.31 49.36 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.519 2.146 . . . . 0.0 112.454 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.12 -47.27 52.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.843 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.458 ' HB3' ' NE2' ' A' ' 168' ' ' GLN . 62.2 m -111.82 -170.96 1.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.238 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.2 15.24 12.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.093 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.458 ' NE2' ' HB3' ' A' ' 166' ' ' SER . 2.4 mp0 -86.75 -35.18 19.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.21 0.529 . . . . 0.0 110.367 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -94.54 153.74 17.74 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.176 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.3 m -133.93 166.86 21.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.885 0.374 . . . . 0.0 111.342 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.03 132.2 48.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.524 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.39 -16.35 60.11 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.2 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -68.73 157.97 35.23 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.003 0.43 . . . . 0.0 111.158 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.404 ' HG2' HG21 ' A' ' 112' ' ' THR . 38.9 mttp -74.12 143.13 45.47 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.498 HG21 HD12 ' A' ' 162' ' ' ILE . 99.5 t -93.17 115.05 31.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.265 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.7 mpt_? -78.93 155.01 29.2 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-O 121.298 0.571 . . . . 0.0 111.615 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 39.0 t -69.42 121.13 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.47 -11.95 36.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.374 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -68.2 127.62 33.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.764 0.316 . . . . 0.0 110.731 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -69.7 110.36 4.85 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.489 HD21 HG13 ' A' ' 175' ' ' VAL . 71.2 mt -96.37 148.54 22.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.757 0.789 . . . . 0.0 113.127 -178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.436 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 54.5 mt -113.53 112.86 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -92.82 138.26 31.64 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.157 0.504 . . . . 0.0 112.052 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 191' ' ' TYR . 77.9 t -130.33 120.45 48.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.001 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 99.9 p -61.04 123.01 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.626 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 89.3 t -66.59 -33.19 61.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -76.04 -39.96 54.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.475 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 49.7 m -113.95 5.37 16.14 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.91 29.86 1.79 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 34.8 mtt85 -110.34 143.21 40.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.899 0.381 . . . . 0.0 110.838 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 56.5 m-85 -74.53 153.83 38.9 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.406 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.4 tp -75.68 76.22 2.67 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 105.322 -2.103 . . . . 0.0 105.322 175.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.1 t60 -76.4 151.79 36.46 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -174.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.7 tp -101.12 116.21 32.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 113.604 -1.635 . . . . 0.0 107.537 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.405 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 46.8 p -109.0 146.95 33.06 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -177.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -105.77 91.08 3.6 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.55 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -77.32 -174.17 40.62 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.329 -0.938 . . . . 0.0 111.594 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.53 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.7 m120 -3.09 -76.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.341 0.656 . . . . 0.0 112.496 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.0 p -147.39 14.3 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.064 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.2 t -128.12 -179.7 5.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.627 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -107.36 135.22 49.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.265 0.555 . . . . 0.0 111.294 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.55 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.7 m-70 -127.93 176.79 7.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.01 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . 0.587 HG13 ' SG ' ' A' ' 47' ' ' CYS . 2.7 p -131.47 131.51 62.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.337 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.93 173.93 12.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.552 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.92 96.1 7.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.86 -179.51 3.65 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.252 -177.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -87.97 7.21 32.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.415 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 39.3 mt-30 -115.39 136.21 53.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.452 . . . . 0.0 110.687 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.42 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.7 mt-30 -64.57 174.68 1.65 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.371 1.081 . . . . 0.0 112.695 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -166.61 119.38 1.02 Allowed 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.093 -1.867 . . . . 0.0 107.826 178.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 47.7 mt -73.16 128.82 36.58 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.514 -0.474 . . . . 0.0 109.948 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.435 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.3 m95 -116.2 145.05 43.41 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.596 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.8 t -112.02 100.49 8.91 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.3 t -92.52 100.66 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.75 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.25 27.73 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.087 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 215' ' ' ALA . 25.5 Cg_exo -63.53 104.33 0.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.071 1.847 . . . . 0.0 111.029 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.495 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 5.7 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.368 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-O 120.717 0.294 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.4 mt -78.16 124.37 27.98 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.8 mmm180 -111.49 158.03 19.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.982 0.42 . . . . 0.0 111.087 -179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 p -68.09 155.23 40.01 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.889 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.1 -7.3 1.34 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.676 -179.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.2 m-20 -68.3 136.16 53.03 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.064 0.459 . . . . 0.0 110.974 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 13.5 tt0 -82.81 119.53 24.48 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.557 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.5 m -136.29 173.12 14.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.668 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.63 139.48 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.278 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.746 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -99.97 120.56 39.99 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.672 0.272 . . . . 0.0 110.67 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -123.07 142.14 51.2 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.454 0.645 . . . . 0.0 112.185 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 194' ' ' LEU . 19.6 t -127.92 146.66 50.57 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.866 178.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.0 m -87.98 122.34 31.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.267 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.613 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.76 122.64 47.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.347 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.2 m -125.68 140.21 52.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.447 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 tt -175.48 139.45 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.761 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.8 m80 57.86 43.19 21.99 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 60.27 23.73 13.14 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.296 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -126.52 123.13 37.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.607 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -117.53 151.25 37.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.195 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -163.36 172.7 14.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.79 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -118.98 138.09 53.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.583 178.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -129.1 139.1 52.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.311 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.579 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 45.3 t -102.09 145.85 28.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.879 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -66.9 116.83 8.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.755 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.44 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . . . -116.48 162.44 17.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.591 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.22 165.56 21.87 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.753 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.58 144.49 39.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.569 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.91 51.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.436 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -123.24 147.59 46.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.847 0.356 . . . . 0.0 110.639 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.12 -139.81 21.58 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.411 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.471 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -78.85 4.66 13.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.72 0.295 . . . . 0.0 110.779 179.763 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.48 32.42 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.908 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 44' ' ' ASN . 40.4 mt -77.6 139.97 39.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.032 0.444 . . . . 0.0 110.472 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.6 m -79.73 151.14 30.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.556 0.693 . . . . 0.0 111.347 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -147.05 -167.85 2.89 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.622 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.7 mt -131.0 145.67 52.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 112.321 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 46.5 mt-10 . . . . . 0 CA--C 1.494 -1.192 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.921 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 21' ' ' VAL . 57.4 tp . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 111.836 0.309 . . . . 0.0 111.836 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.523 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.2 t -51.58 -52.7 45.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.68 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 38' ' ' ALA . 37.9 pt -71.57 -14.46 17.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.668 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.53 -3.26 46.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.428 0.632 . . . . 0.0 110.059 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.492 HG22 ' OG ' ' A' ' 124' ' ' SER . 37.7 m -84.77 134.11 34.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.123 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -137.66 162.13 34.65 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.782 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.582 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -125.62 133.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.733 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 mt -82.32 63.77 6.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.5 mm-40 -43.7 -61.03 1.53 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -178.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.402 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 11.0 mm100 -124.97 163.93 21.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.708 0.766 . . . . 0.0 112.977 -177.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.32 84.38 0.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.363 -1.29 . . . . 0.0 108.995 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.45 154.83 25.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.367 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.4 p -67.88 147.12 52.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.428 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.7 t -49.44 -44.99 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.088 0.47 . . . . 0.0 110.354 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -56.65 -54.21 48.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.227 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.77 97.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.9 tp -59.78 -49.3 78.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.065 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 24.4 mt-30 . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.755 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.787 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.3 mm-40 . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.787 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -87.06 -50.77 6.42 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-N 120.45 1.477 . . . . 0.0 111.624 -2.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.635 ' H ' ' HG2' ' A' ' 97' ' ' LYS . 4.7 m-90 -66.24 -28.68 68.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.941 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.685 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -61.17 -39.47 90.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.174 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.737 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 36.3 t80 -74.28 -42.24 59.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.785 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.6 tpt -56.64 -49.42 75.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.932 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.2 mtm -71.54 -38.04 71.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -57.56 -45.76 84.75 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.859 0.361 . . . . 0.0 110.512 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.7 p -72.96 -39.28 66.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.701 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.02 69.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.074 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 179.898 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 . . . . . 0 CA--C 1.527 0.064 0 CA-C-O 121.073 0.463 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.408 HG21 ' HG2' ' A' ' 174' ' ' LYS . 93.3 m -75.76 148.09 38.77 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.052 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -81.34 131.63 35.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.837 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 77.9 mt -116.03 141.55 47.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.218 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -61.56 130.71 47.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.458 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.31 -12.7 60.15 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.037 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.99 141.53 32.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.12 0.485 . . . . 0.0 111.27 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.58 127.77 33.67 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.4 pt -112.77 159.42 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.556 0.693 . . . . 0.0 112.746 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.402 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.07 109.7 18.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.864 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.9 mt -97.4 116.97 30.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.629 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.582 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.4 ttp85 -103.4 116.01 31.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.777 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.5 t-80 -58.27 108.16 0.58 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 177.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.492 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -51.72 -48.33 63.64 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.523 ' HD1' ' HG ' ' A' ' 63' ' ' SER . 68.7 t80 -61.21 -64.63 0.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.439 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -72.12 -19.87 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.9 -0.19 73.06 Favored Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.236 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.6 mtt -83.32 -165.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.411 0.148 . . . . 0.0 110.636 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.478 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.2 m-85 -133.75 138.53 45.81 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.401 HD13 HD21 ' A' ' 37' ' ' LEU . 22.1 tp -55.39 127.4 29.35 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 177.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.586 ' SG ' HD21 ' A' ' 133' ' ' LEU . 20.5 p -137.02 150.01 47.83 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.0 t -95.36 99.53 11.45 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.589 -1.264 . . . . 0.0 107.589 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.586 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.2 mt -75.45 152.74 37.89 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.888 -178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.6 p -78.53 -5.71 53.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.81 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 31.1 p -85.32 124.16 31.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.729 0.299 . . . . 0.0 110.884 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 51.6 m . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.864 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.308 0.575 . . . . 0.0 111.948 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.506 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.0 m-85 -101.23 172.46 6.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.029 177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.06 142.93 27.23 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 62.9 t -111.48 117.52 55.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.383 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.35 -150.28 5.99 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.082 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.6 mt -115.14 146.36 41.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.036 0.446 . . . . 0.0 111.029 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.482 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 7.2 tp60 -137.62 143.65 41.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.705 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.37 -50.75 12.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -81.82 143.25 31.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 77.6 p -106.49 -6.66 17.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 110.978 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 66.8 p -54.84 114.23 1.64 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.46 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.28 -158.15 21.51 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.462 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.469 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.4 mt-10 -121.11 -12.48 8.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.765 0.317 . . . . 0.0 111.357 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.57 -32.15 68.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.122 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 79.7 m -90.86 6.2 45.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.718 0.295 . . . . 0.0 111.593 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -110.07 134.07 52.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.015 0.436 . . . . 0.0 111.365 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.474 ' O ' HG12 ' A' ' 119' ' ' ILE . 51.7 m95 -128.02 117.41 21.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.611 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.429 HG23 HG22 ' A' ' 186' ' ' VAL . 13.5 p -78.84 125.89 29.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.057 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.48 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.13 136.17 23.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.919 0.39 . . . . 0.0 110.89 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.42 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.23 150.17 73.29 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.662 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.5 Cg_endo -66.16 137.58 48.51 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.377 2.051 . . . . 0.0 112.407 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.51 -40.93 41.13 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.289 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 58.6 m -103.49 -173.55 2.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.406 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.406 ' O ' ' HD3' ' A' ' 167' ' ' LYS . 14.0 tmtt? -95.22 -2.12 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.931 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.09 -33.31 44.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.035 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.662 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 58.7 mmt-85 -86.88 144.86 26.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.606 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 48.8 m -127.23 167.93 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.327 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.7 134.21 51.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.1 59.5 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.285 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -67.93 156.98 36.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.408 ' HG2' HG21 ' A' ' 112' ' ' THR . 63.3 mttt -73.56 141.68 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.366 178.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 162' ' ' ILE . 97.4 t -91.82 113.64 27.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.358 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -78.43 154.79 30.34 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.337 0.589 . . . . 0.0 111.57 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 48.0 t -69.96 122.16 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.322 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.26 -11.55 36.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.07 127.71 33.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.891 0.376 . . . . 0.0 110.935 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.439 ' HA ' ' O ' ' A' ' 212' ' ' TRP . 6.8 m-20 -69.82 114.02 7.61 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 175' ' ' VAL . 70.1 mt -99.78 149.5 23.29 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.481 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.9 mt -114.3 112.3 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -92.24 138.12 31.79 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.063 0.459 . . . . 0.0 112.048 -178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.474 HG22 ' CD1' ' A' ' 191' ' ' TYR . 80.0 t -130.48 127.99 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.709 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.8 m -64.59 123.16 18.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.469 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.2 t -67.44 -30.26 48.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.832 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.9 t -79.13 -38.38 36.22 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.461 ' HB2' HH11 ' A' ' 190' ' ' ARG . 94.2 p -120.52 10.61 11.17 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 45.29 33.07 1.12 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 39.1 mtt85 -109.01 138.39 45.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.961 0.41 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.5 m-85 -72.2 153.06 41.83 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.404 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.4 tp -75.28 75.5 2.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 175.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -74.15 151.12 40.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -174.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.2 tp -101.53 115.8 31.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.721 -1.582 . . . . 0.0 107.645 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.4 p -109.28 145.83 35.3 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -105.7 92.45 4.18 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.73 -174.3 46.39 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.266 -0.968 . . . . 0.0 111.368 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 39.6 m-80 -1.14 -78.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.298 0.639 . . . . 0.0 112.52 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.6 p -146.68 12.87 1.16 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.07 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 49.9 m -126.74 -178.45 4.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.613 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.0 m95 -108.53 135.47 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.281 0.563 . . . . 0.0 111.328 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.471 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 22.8 m-70 -127.66 175.33 8.37 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.064 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.23 133.69 63.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.443 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.7 172.15 16.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.605 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.77 95.99 7.59 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.93 179.18 4.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.325 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -87.21 8.16 25.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.835 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.456 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 37.2 mt-30 -114.16 134.98 54.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.721 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.481 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.4 mt-30 -64.05 174.32 1.58 Allowed 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.296 1.046 . . . . 0.0 112.742 -178.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.2 m -167.85 121.6 0.94 Allowed 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 113.102 -1.863 . . . . 0.0 107.912 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.422 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 41.1 mt -76.37 130.31 37.88 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.122 0.487 . . . . 0.0 109.885 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.439 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.1 m95 -117.54 147.58 42.66 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.705 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -114.02 99.19 7.46 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.377 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.746 HG22 ' HG ' ' A' ' 22' ' ' LEU . 94.8 t -91.85 100.78 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.759 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.83 140.69 25.76 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.092 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 19' ' ' GLU . 27.9 Cg_exo -62.1 104.69 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.079 1.853 . . . . 0.0 111.251 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.557 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.235 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-O 120.755 0.312 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.7 mt -81.96 120.5 25.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 15' ' ' ARG . 7.8 mmm180 -109.12 158.65 17.58 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.99 0.424 . . . . 0.0 111.035 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 p -67.75 157.22 35.19 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.793 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 69.03 -2.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.877 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -74.25 134.36 42.66 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.468 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -79.68 119.37 22.52 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.533 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.9 m -136.88 169.64 19.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.663 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -132.22 140.28 48.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 108.398 176.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.769 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.22 122.01 42.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.691 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 42.9 mt-30 -122.15 151.77 40.62 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.527 0.679 . . . . 0.0 111.889 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.1 p -137.57 140.8 41.23 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.808 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -83.26 122.82 28.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.157 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.622 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.81 120.96 40.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.4 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.3 m -125.66 140.15 52.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.428 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.1 tt -175.71 143.13 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.642 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.1 m80 58.09 39.23 26.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.749 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.25 26.22 15.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.049 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -129.26 122.84 30.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.575 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.02 149.15 39.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -161.16 174.15 14.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.67 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 18.5 mtpp -120.98 135.19 55.27 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.504 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.2 mt -125.18 142.33 51.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.568 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 43.8 t -106.44 142.97 35.23 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.894 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.479 HD21 HD13 ' A' ' 130' ' ' LEU . 27.0 tp -63.49 115.61 4.81 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.795 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.19 164.69 14.11 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.683 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.82 165.47 9.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.683 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.93 144.64 39.15 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.627 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -82.26 17.55 17.83 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.662 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -126.75 151.95 47.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 0.0 110.446 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.15 -135.86 15.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.262 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.502 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -85.56 8.12 20.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.706 0.289 . . . . 0.0 110.78 179.649 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.0 29.23 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.922 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.502 ' H ' HD22 ' A' ' 44' ' ' ASN . 42.9 mt -78.11 142.25 38.21 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 120.974 0.416 . . . . 0.0 110.55 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.62 151.4 25.34 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.512 0.672 . . . . 0.0 111.098 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 64' ' ' ILE . 21.9 p90 -144.9 -167.58 2.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.763 -1.108 . . . . 0.0 108.555 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.36 142.6 50.1 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.402 -0.519 . . . . 0.0 112.305 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 48.1 mt-10 . . . . . 0 CA--C 1.495 -1.147 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.158 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.504 HD11 HG11 ' A' ' 21' ' ' VAL . 50.5 tp . . . . . 0 C--O 1.231 0.097 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.463 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.4 t -50.07 -51.09 45.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.744 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.408 HD12 ' CZ ' ' A' ' 48' ' ' PHE . 33.2 pt -72.05 -15.97 18.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.887 0.375 . . . . 0.0 111.593 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.663 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.97 -1.52 45.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.339 0.59 . . . . 0.0 110.307 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.494 HG22 ' OG ' ' A' ' 124' ' ' SER . 34.0 m -85.92 135.65 33.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.022 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.16 161.88 36.32 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -125.73 132.88 70.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.65 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.419 HD23 ' CD2' ' A' ' 121' ' ' LEU . 15.4 mt -82.01 66.93 7.8 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.2 mm-40 -46.28 -62.5 1.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.405 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.2 mm100 -121.67 165.72 15.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.667 0.746 . . . . 0.0 112.963 -177.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -158.93 82.72 0.79 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.9 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -111.37 156.55 21.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.413 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.0 t -69.77 147.15 50.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.22 -45.33 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.477 . . . . 0.0 110.254 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 ttp85 -55.5 -54.72 40.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.295 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.41 -45.17 94.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.015 -179.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.0 tp -59.93 -46.54 89.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.394 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 120.928 0.394 . . . . 0.0 110.772 -179.987 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.77 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.6 mm-40 . . . . . 0 CA--C 1.534 0.341 0 CA-C-O 118.861 -0.59 . . . . 0.0 112.224 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.7 ptmt -86.55 -44.15 12.15 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.971 1.308 . . . . 0.0 110.826 -3.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -53.35 -49.42 67.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.219 -1.355 . . . . 0.0 112.731 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.527 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 55.3 mtpt -55.48 -30.59 60.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.667 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.77 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.2 t80 -73.81 -48.23 32.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.026 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.09 -42.51 85.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.11 -39.43 72.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.653 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -60.61 -39.91 89.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.542 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.6 m -72.39 -49.16 35.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.256 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.98 78.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.495 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.015 -179.811 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 121.022 0.439 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.5 m -75.81 148.38 38.46 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.027 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -81.74 129.58 34.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -114.92 143.13 45.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.252 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -62.57 133.23 54.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.024 0.44 . . . . 0.0 110.471 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.7 -11.64 64.59 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.048 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.441 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.09 139.74 32.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.982 0.42 . . . . 0.0 111.356 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.42 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.26 128.71 34.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.8 pt -113.39 159.22 13.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.547 0.689 . . . . 0.0 112.792 -178.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.405 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.0 tp -115.4 108.39 16.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.858 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.419 ' CD2' HD23 ' A' ' 69' ' ' LEU . 48.3 mt -95.76 118.11 31.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.665 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 19.7 ttp180 -103.75 115.36 30.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.669 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.494 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.1 t-80 -57.44 109.5 0.7 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.494 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -52.75 -48.81 66.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.494 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 77.4 t80 -61.6 -62.5 1.76 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.443 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.7 p -73.26 -20.74 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.81 -1.23 74.46 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.084 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.3 mtt -83.37 -165.92 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 60.0 m-85 -133.03 139.06 47.02 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.479 HD13 HD21 ' A' ' 37' ' ' LEU . 24.2 tp -54.42 129.53 36.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.4 t -138.81 147.32 42.39 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.6 t -94.04 98.05 10.74 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -73.74 156.83 37.46 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.559 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.0 m -81.61 -10.38 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.432 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -87.13 123.75 32.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.711 0.291 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 57.9 m . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.564 0 CA-C-O 121.326 0.584 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 15.7 m-85 -103.17 169.43 8.56 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.928 178.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -88.26 144.09 26.64 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 99.1 t -113.51 116.09 51.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.463 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.72 -147.89 5.76 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.323 -0.941 . . . . 0.0 112.695 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 70.2 mt -116.3 153.49 31.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.828 0.346 . . . . 0.0 110.618 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -143.62 139.21 29.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.81 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.96 -69.24 0.36 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.473 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.75 143.77 51.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.589 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . 0.401 HG21 HD21 ' A' ' 120' ' ' LEU . 52.3 p -103.15 1.32 33.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.349 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -56.23 115.12 2.27 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.56 -161.89 18.9 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.613 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.487 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 33.8 mt-10 -117.07 -11.25 10.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.815 0.341 . . . . 0.0 111.273 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.71 67.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 83.8 m -92.22 9.45 33.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.22 132.5 54.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.099 0.476 . . . . 0.0 111.361 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.4 m95 -127.45 117.15 21.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.597 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 7.4 p -79.06 128.14 32.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.267 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.528 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -89.48 133.41 31.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 111.052 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.464 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.5 m80 -126.57 150.15 69.99 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.2 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.702 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.3 Cg_endo -67.54 137.52 42.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.519 2.146 . . . . 0.0 112.065 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.29 -43.42 56.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.688 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 54.9 m -106.88 -174.04 2.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.039 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.63 8.06 40.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.157 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -83.83 -34.67 24.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.853 -179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.702 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -90.02 148.23 23.19 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.531 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 51.1 m -128.13 167.15 17.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.98 135.76 55.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 89.29 -16.88 54.85 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.395 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 23.8 mt-10 -67.41 154.97 40.13 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.924 0.393 . . . . 0.0 111.161 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -71.87 142.15 49.56 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 178.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.528 HG21 HD12 ' A' ' 162' ' ' ILE . 92.5 t -91.53 113.03 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.755 0.312 . . . . 0.0 110.412 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -75.51 152.96 37.75 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.34 0.591 . . . . 0.0 111.5 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.444 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.6 t -68.94 121.43 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.69 -11.9 35.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.342 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.36 130.34 42.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.831 0.348 . . . . 0.0 110.905 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 13.2 m-20 -71.95 112.18 7.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 76.5 mt -98.13 150.07 21.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.464 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.4 mt -114.32 112.89 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -92.75 136.28 33.38 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.191 0.52 . . . . 0.0 112.129 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.453 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.7 t -128.74 126.27 64.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.862 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 5.3 m -63.93 125.47 24.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -70.63 -32.05 48.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.682 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.7 t -81.21 -36.31 30.23 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 53.1 m -114.98 5.51 15.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 45.22 33.16 1.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -116.09 142.47 46.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.989 0.424 . . . . 0.0 110.772 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.8 m-85 -72.6 153.84 41.06 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 27.3 tp -75.31 76.45 2.41 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 175.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -75.54 150.74 38.05 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -174.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -101.59 114.39 28.39 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.705 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.419 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 48.2 t -107.88 146.24 32.6 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -177.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -106.41 91.2 3.6 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.02 -179.73 52.98 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.032 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 35.1 m-80 7.65 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.23 0.612 . . . . 0.0 112.386 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 49.7 m -142.19 5.71 1.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.349 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.1 m -120.89 -179.31 3.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.206 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.622 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.6 m95 -106.27 139.3 40.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.274 0.559 . . . . 0.0 111.198 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.439 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 32.4 m-70 -130.26 172.08 12.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.962 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.88 132.6 69.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.295 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.419 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.8 p30 -150.31 170.19 19.6 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.588 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.49 93.77 6.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.307 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.07 175.8 5.29 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.268 -177.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.02 10.66 9.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.195 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 14.0 mm100 -117.6 136.5 53.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.684 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' A' ' 209' ' ' GLN . 21.3 mt-30 -64.56 175.61 1.35 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.434 1.111 . . . . 0.0 113.151 -178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.7 m -169.49 120.07 0.68 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 112.919 -1.946 . . . . 0.0 107.721 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 31.6 mt -74.76 128.91 36.71 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.923 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.35 144.88 43.1 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.566 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.9 t -112.44 101.18 9.37 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.428 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.769 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.6 t -92.68 100.48 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.779 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -111.46 142.15 25.92 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.446 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.1 Cg_exo -63.68 103.73 0.41 Allowed 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.209 1.939 . . . . 0.0 111.365 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.533 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.926 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.6 mt -80.73 122.59 27.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.4 mmm180 -109.75 157.29 19.29 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 111.182 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.409 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.1 p -67.82 156.45 37.07 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.763 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.74 -9.9 1.03 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.69 -179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.9 m-20 -67.72 134.09 50.45 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -79.8 120.41 24.03 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.471 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.7 m -136.35 172.99 14.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -135.16 139.23 47.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.304 176.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.779 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.2 mp -100.04 122.62 43.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.529 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.453 HE22 ' HE2' ' A' ' 34' ' ' LYS . 18.5 mt-30 -123.04 146.02 48.03 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.625 0.726 . . . . 0.0 112.223 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -131.38 142.56 50.07 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.752 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.7 m -84.25 120.95 26.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.322 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.588 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.99 117.51 31.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.216 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.1 m -122.02 137.02 54.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.023 0.44 . . . . 0.0 111.731 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -171.89 144.8 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.496 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.3 m80 60.19 34.84 21.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt 64.19 25.43 13.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.133 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -128.37 126.66 41.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.177 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -116.26 141.86 47.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 111.571 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -151.59 174.39 13.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.633 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HE2' HE22 ' A' ' 23' ' ' GLN . 27.7 mtmm -122.28 135.54 54.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.645 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -124.62 141.58 51.99 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.523 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.3 t -104.76 142.34 34.89 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.684 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.49 ' HA ' HD23 ' A' ' 49' ' ' LEU . 35.7 tp -60.93 112.93 2.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.684 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.426 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.73 163.4 14.19 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.515 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.73 160.21 10.39 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.405 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.7 141.85 48.78 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.622 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.414 ' HA2' ' CE ' ' A' ' 128' ' ' MET . . . -81.82 16.36 21.11 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.193 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -122.13 148.52 44.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 0.0 110.714 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.58 -138.39 20.24 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.583 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -81.54 8.83 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.644 0.259 . . . . 0.0 110.971 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.08 31.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.249 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.9 mt -78.31 138.65 38.69 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 110.556 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.3 m -79.86 151.47 30.19 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.631 0.729 . . . . 0.0 111.413 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.71 -161.9 1.42 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.558 -1.201 . . . . 0.0 108.348 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.5 mt -132.89 145.36 50.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.0 112.066 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.4 tt0 . . . . . 0 CA--C 1.503 -0.847 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.526 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.623 HD11 HG11 ' A' ' 21' ' ' VAL . 44.8 tp . . . . . 0 CA--C 1.527 0.09 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.3 p -46.83 -51.87 15.56 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.426 HD12 ' HB1' ' A' ' 38' ' ' ALA . 32.1 pt -71.38 -17.32 19.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.19 -1.33 42.35 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.937 0.399 . . . . 0.0 111.452 -179.233 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.487 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.1 m -84.66 132.9 34.42 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -137.07 162.91 32.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.971 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -126.27 133.92 67.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 HG11 ' A' ' 20' ' ' VAL . 18.4 mt -82.64 66.55 8.3 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.483 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.7 mm-40 -45.5 -64.62 0.69 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.453 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -122.98 165.26 17.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.773 0.797 . . . . 0.0 113.033 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.8 m -156.11 86.12 1.03 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.114 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.5 mt -112.96 157.09 21.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.514 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.7 t -69.65 146.86 51.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.9 t -50.36 -45.73 25.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.12 0.486 . . . . 0.0 110.236 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -57.18 -51.57 68.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.218 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.19 -44.63 96.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.789 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.72 -46.75 89.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.263 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 . . . . . 0 C--N 1.325 -0.472 0 CA-C-O 120.925 0.393 . . . . 0.0 110.569 179.935 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.713 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.916 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 89.9 mttt -89.38 -57.61 2.82 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 123.068 1.414 . . . . 0.0 108.843 -5.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -77.8 -27.39 50.11 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 112.873 -1.967 . . . . 0.0 111.655 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.0 -59.2 5.41 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.249 -0.58 . . . . 0.0 111.068 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.555 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.5 t80 -77.33 -36.01 54.27 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.919 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.4 ttt -57.26 -38.53 74.01 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.082 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.5 ttt -76.64 -42.8 40.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -57.0 -42.43 80.26 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.844 0.354 . . . . 0.0 110.249 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -72.52 -44.37 62.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.655 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.35 -31.84 66.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.83 179.652 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 121.054 0.454 . . . . 0.0 111.625 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.3 m -77.45 147.35 35.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.17 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.42 130.84 35.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 84.2 mt -114.98 142.35 46.75 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.226 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -63.17 132.37 51.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.977 0.418 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.47 -15.64 59.79 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.979 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -80.51 141.63 34.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.102 0.477 . . . . 0.0 111.568 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.02 127.32 33.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.132 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.0 pt -112.01 162.82 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.492 0.663 . . . . 0.0 112.761 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.453 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.9 tp -118.73 109.99 16.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.949 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -98.0 117.77 33.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.615 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.483 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.7 ttp-105 -104.08 116.15 31.7 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.438 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.2 t-80 -58.11 109.06 0.68 Allowed 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.487 ' OG ' HG22 ' A' ' 66' ' ' THR . 69.9 m -50.07 -54.13 22.43 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.438 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 46.7 t80 -57.54 -69.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.411 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.5 p -62.76 -29.39 70.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.73 -1.82 88.01 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.085 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . 0.414 ' CE ' ' HA2' ' A' ' 41' ' ' GLY . 64.1 mtm -85.29 -165.69 1.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.193 . . . . 0.0 110.575 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 59.0 m-85 -132.27 140.07 48.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.463 HD13 HD21 ' A' ' 37' ' ' LEU . 24.7 tp -55.03 128.46 33.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 177.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.8 t -137.97 147.7 44.51 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -176.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -94.58 97.98 10.5 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.502 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.2 mt -74.71 155.45 37.69 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.341 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -85.72 3.97 38.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.928 -178.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 64.2 p -92.2 123.72 35.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.649 0.262 . . . . 0.0 110.977 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.682 179.966 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . . . . . . 0 N--CA 1.449 -0.489 0 CA-C-O 121.493 0.664 . . . . 0.0 112.236 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 18.8 m-85 -101.81 173.03 6.59 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.963 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -90.98 141.99 28.25 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.7 117.68 55.71 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.346 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.84 -150.66 6.13 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.769 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 72.3 mt -114.39 148.43 37.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.902 0.382 . . . . 0.0 110.618 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -135.22 141.58 45.83 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.39 -58.7 3.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.71 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -82.64 151.69 26.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.883 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.7 p -107.33 -3.19 19.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.162 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.8 p -56.71 113.02 1.46 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.14 -159.02 22.23 Favored Glycine 0 N--CA 1.442 -0.965 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.517 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 42.1 mt-10 -120.63 -12.54 8.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.781 0.324 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.87 -32.24 67.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.214 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.0 m -92.17 9.1 35.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -111.69 131.45 55.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.147 0.498 . . . . 0.0 111.408 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -126.47 117.52 23.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.775 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -79.07 126.4 30.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.101 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.466 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -88.56 135.17 26.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.855 0.359 . . . . 0.0 111.009 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.486 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.6 m80 -127.25 151.58 74.8 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.149 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.5 Cg_endo -67.6 138.83 46.76 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.554 2.169 . . . . 0.0 112.275 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.72 -42.38 41.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.447 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 36.4 m -105.01 -173.09 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.416 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -95.41 6.92 47.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.475 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -86.23 -34.26 20.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.947 0.403 . . . . 0.0 110.792 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.4 mmp_? -86.78 146.52 26.21 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 33.9 t -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.429 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.84 129.08 38.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.253 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.24 -13.61 64.44 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.999 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.8 158.47 36.03 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.943 0.401 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -74.09 143.16 45.51 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.466 HG21 HD12 ' A' ' 162' ' ' ILE . 89.8 t -93.48 114.93 31.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.264 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -80.74 155.0 26.93 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 121.325 0.583 . . . . 0.0 111.709 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.84 122.82 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.54 -18.0 27.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.922 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -66.88 128.79 37.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.746 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.457 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.3 m-20 -72.99 116.54 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.429 HD21 HG13 ' A' ' 175' ' ' VAL . 61.7 mt -99.73 149.43 23.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.486 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 56.2 mt -114.31 112.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 176.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.71 137.61 32.21 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.177 0.513 . . . . 0.0 112.278 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.443 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.7 t -130.41 124.21 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.841 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 32.2 t -63.06 127.46 31.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 97.7 t -71.39 -32.26 46.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 120.896 0.379 . . . . 0.0 110.814 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.1 p -78.91 -39.42 34.87 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.477 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 55.1 m -114.06 4.91 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.32 31.15 1.7 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -112.32 144.18 42.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.93 0.395 . . . . 0.0 110.69 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.474 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.8 m-85 -74.15 152.57 39.81 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 41.3 tp -75.15 77.6 2.3 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -77.75 150.44 34.38 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -174.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.8 tp -100.1 119.16 37.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.532 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.3 t -113.01 147.19 37.69 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.55 90.17 3.25 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.09 -175.03 46.32 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.17 -1.014 . . . . 0.0 111.437 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 34.8 m-80 1.11 -78.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.368 0.667 . . . . 0.0 112.496 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 34.6 t -147.05 11.38 1.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 52.2 m -125.88 -178.97 4.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.982 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.588 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.2 135.6 48.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.21 0.528 . . . . 0.0 111.195 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.469 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 29.9 m-70 -127.23 174.73 8.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.79 130.07 66.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.283 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -147.05 172.31 13.93 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.606 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.26 92.31 5.38 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.61 179.64 4.02 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.562 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -88.11 11.38 16.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.298 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -119.6 137.65 53.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.697 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.31 175.58 1.28 Allowed 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 122.352 1.072 . . . . 0.0 112.997 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.8 m -169.36 119.84 0.69 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.794 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 39.6 mt -74.36 129.41 37.74 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.045 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.412 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.9 m95 -116.04 146.77 41.9 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.449 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -115.02 101.89 9.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.318 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.779 HG22 ' HG ' ' A' ' 22' ' ' LEU . 61.9 t -93.49 101.58 12.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.975 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.0 143.23 29.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.098 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.38 105.26 0.59 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.237 1.958 . . . . 0.0 111.366 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.471 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.94 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.8 mt -80.11 122.47 26.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 178.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.2 mmm180 -111.71 158.05 19.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.186 0.517 . . . . 0.0 111.315 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -68.06 155.79 38.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.7 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 16' ' ' THR . 7.5 m-20 71.18 -3.46 2.06 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.841 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.431 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.7 m-20 -72.74 138.35 46.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -84.74 119.39 25.22 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.5 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -135.83 170.54 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -177.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.564 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.66 135.91 58.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.267 176.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.777 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -97.04 123.06 40.67 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.519 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.457 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 38.2 mt-30 -120.2 164.83 15.63 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.275 0.56 . . . . 0.0 111.355 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -151.82 142.88 23.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.49 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -86.99 119.73 27.5 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.43 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.11 119.84 39.23 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.851 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.7 m -123.88 132.01 53.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 112.037 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.528 HG23 ' CD2' ' A' ' 29' ' ' HIS . 17.7 tt -168.9 148.94 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.446 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.528 ' CD2' HG23 ' A' ' 28' ' ' ILE . 47.7 m-70 58.23 42.0 22.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 59.82 23.21 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.28 179.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -126.5 145.68 50.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.412 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -130.71 142.52 50.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.924 0.392 . . . . 0.0 111.2 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.492 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -153.9 171.55 18.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.853 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 34' ' ' LYS . 17.3 mtpp -120.39 138.18 53.9 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.419 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.492 HD21 ' OE1' ' A' ' 33' ' ' GLN . 1.5 mt -127.14 145.43 50.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.21 137.62 46.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.987 0.423 . . . . 0.0 110.549 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.555 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -60.83 111.69 1.75 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.168 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.438 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.56 165.54 11.73 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.417 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.89 162.02 11.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.802 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.57 148.09 50.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.7 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.9 -0.57 89.77 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.737 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -112.22 158.02 20.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.841 0.353 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.36 -136.15 16.18 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.464 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.435 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 1.2 p30 -87.12 7.86 26.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.695 0.283 . . . . 0.0 110.877 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.87 28.84 0.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.323 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.8 mt -79.41 141.13 37.13 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.2 m -80.93 150.04 29.15 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.476 0.655 . . . . 0.0 111.245 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -144.14 -168.72 2.95 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.743 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.555 HD23 ' HA ' ' A' ' 37' ' ' LEU . 22.7 mt -130.94 144.53 51.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.422 0.63 . . . . 0.0 112.361 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.2 mt-10 . . . . . 0 CA--C 1.503 -0.854 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.819 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.564 HD11 HG11 ' A' ' 21' ' ' VAL . 50.1 tp . . . . . 0 C--O 1.232 0.153 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.3 m -52.32 -46.52 66.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -70.92 -20.34 21.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 57.1 m -97.71 13.02 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.072 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.505 HG22 ' OG ' ' A' ' 124' ' ' SER . 25.8 m -91.36 130.37 37.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.15 0.5 . . . . 0.0 111.91 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.06 161.53 35.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.108 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.66 133.34 69.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.609 178.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.1 mt -81.49 65.5 6.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.8 mm-40 -44.55 -60.23 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.406 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 58.2 mm-40 -126.42 163.67 22.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.706 0.765 . . . . 0.0 112.839 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.6 t -155.43 84.06 1.05 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.476 -1.238 . . . . 0.0 108.999 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -111.73 152.65 27.52 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.33 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.4 t -65.4 148.55 51.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -50.44 -46.09 26.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.027 0.441 . . . . 0.0 110.288 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -55.55 -57.56 11.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.129 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.35 -44.76 84.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.177 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.8 -50.88 72.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.104 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.629 179.901 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.782 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 31.8 mm-40 . . . . . 0 CA--C 1.533 0.317 0 CA-C-O 118.735 -0.65 . . . . 0.0 112.37 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.723 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 26.1 ttmt -86.64 -50.6 6.68 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.363 1.465 . . . . 0.0 111.487 -2.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 51.6 t-105 -54.86 -36.68 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.319 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 88.0 tttt -65.75 -32.82 74.58 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.771 -178.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.782 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -74.1 -49.37 24.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.999 0.428 . . . . 0.0 109.885 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 53.7 ttp -61.06 -37.94 84.42 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.763 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttp -73.41 -40.19 64.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.983 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -61.34 -45.21 95.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.788 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 48.9 p -70.85 -45.27 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.292 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.88 -31.08 72.05 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.257 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.973 -179.709 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 19.2 ptp180 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 121.041 0.448 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.479 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 75.0 m -78.45 147.02 34.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.286 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.0 131.55 35.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.679 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 75.2 mt -115.29 143.39 45.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.046 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -62.79 132.68 53.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.041 0.448 . . . . 0.0 110.554 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.91 -11.84 64.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.039 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.93 141.42 32.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.038 0.447 . . . . 0.0 111.267 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.87 127.42 33.48 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 49.0 pt -111.41 161.87 9.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.565 0.698 . . . . 0.0 112.692 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 24.0 tp -117.74 108.25 15.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.809 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 54.7 mt -96.37 116.85 29.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.832 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.493 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 13.4 ttp-105 -102.94 116.26 32.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.671 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.2 t-80 -58.44 108.32 0.61 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.505 ' OG ' HG22 ' A' ' 66' ' ' THR . 58.6 m -49.71 -53.09 26.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.434 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.3 t80 -58.57 -69.7 0.18 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -64.99 -23.75 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.27 -1.92 83.5 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.309 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.2 mtt -81.56 -164.65 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.503 0.192 . . . . 0.0 110.644 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.9 m-85 -134.77 137.87 43.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.04 129.2 29.99 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -138.26 147.6 43.85 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.7 t -94.98 96.45 9.29 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.498 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.6 mt -71.44 156.66 39.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.574 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 45.7 t -83.13 -7.31 59.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.189 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 72.5 p -88.63 121.14 30.69 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.854 0.359 . . . . 0.0 111.23 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.559 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 28.6 t . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.617 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 CA--C 1.514 -0.438 0 CA-C-O 121.528 0.68 . . . . 0.0 112.158 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 18.5 m-85 -100.01 171.01 8.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.04 177.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -89.37 144.05 26.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 76.6 t -113.4 117.07 54.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.0 -147.19 5.6 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.307 -0.949 . . . . 0.0 113.006 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.7 mt -117.34 147.74 42.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.94 0.4 . . . . 0.0 111.074 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -136.05 142.95 44.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.742 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -75.4 -55.77 5.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.783 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.43 145.82 30.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 0.0 110.882 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.3 p -103.59 -8.04 20.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.994 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 69.0 p -55.09 109.95 0.6 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.408 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.65 -158.36 23.21 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.42 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -122.13 -13.39 8.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.704 0.288 . . . . 0.0 111.124 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.13 67.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.094 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.9 m -91.96 8.3 38.16 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.43 132.39 54.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.106 0.479 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.74 117.89 22.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.63 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.434 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 16.0 p -78.99 125.8 29.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.172 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.478 HD12 HG21 ' A' ' 175' ' ' VAL . 3.4 pt -87.83 136.45 23.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.851 0.357 . . . . 0.0 110.676 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.489 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.8 m80 -129.04 150.21 74.71 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.644 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.0 Cg_endo -67.17 138.72 48.14 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.205 . . . . 0.0 112.287 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.23 66.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 63.1 m -112.82 -167.78 1.23 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.176 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -91.59 -13.35 32.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.903 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.03 -35.71 81.13 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.997 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 75.9 mmt-85 -91.31 143.87 26.19 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 56.0 m -124.82 166.4 16.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.414 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.84 131.21 45.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.545 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.41 -14.88 64.27 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.082 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -68.77 154.71 41.48 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.947 0.403 . . . . 0.0 111.043 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -70.55 142.89 51.74 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.478 HG21 HD12 ' A' ' 162' ' ' ILE . 93.3 t -93.03 110.92 23.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.498 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 153.23 40.14 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 121.289 0.566 . . . . 0.0 111.363 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 16.5 t -69.66 120.88 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 176.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.25 -13.75 30.96 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.304 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -67.58 132.28 47.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.321 . . . . 0.0 111.001 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.1 m-20 -73.1 116.17 13.3 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.421 HD21 HG13 ' A' ' 175' ' ' VAL . 60.7 mt -101.43 148.83 24.71 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.676 0.751 . . . . 0.0 112.964 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.9 mt -113.53 113.81 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 176.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -93.6 137.28 33.03 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.112 0.482 . . . . 0.0 112.224 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.438 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.5 t -130.52 125.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.793 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.6 t -63.88 125.62 24.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.853 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 98.6 t -70.14 -30.81 45.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.88 0.372 . . . . 0.0 110.711 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.2 t -81.6 -33.78 31.32 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 69.9 m -120.77 10.16 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.498 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.3 31.19 0.36 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.498 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 27.4 mtt85 -112.2 142.66 44.41 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.089 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.475 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 58.8 m-85 -73.76 152.41 40.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 36.9 tp -74.76 75.99 2.08 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.64 149.47 38.18 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -174.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.54 116.46 31.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.753 -1.567 . . . . 0.0 107.768 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 51.7 p -110.05 146.26 35.67 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -105.68 92.67 4.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -80.82 -174.84 49.03 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.435 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.1 m-80 0.66 -79.37 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.283 0.633 . . . . 0.0 112.409 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.8 p -146.61 12.2 1.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.98 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.7 p -125.94 -179.45 4.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.1 m95 -106.85 136.45 46.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.18 0.514 . . . . 0.0 111.196 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.515 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 26.6 m-70 -128.66 173.01 10.68 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.009 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.02 136.43 60.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.231 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -154.0 172.24 17.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.572 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.476 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -99.15 95.2 6.93 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.095 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.72 -179.4 3.63 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.321 -177.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -88.67 8.59 27.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.178 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 47.2 mt-30 -116.02 138.19 51.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.769 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.413 HE21 ' HB2' ' A' ' 209' ' ' GLN . 21.5 mt-30 -66.62 175.63 2.26 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.319 1.057 . . . . 0.0 113.242 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.0 m -170.04 121.3 0.65 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.954 -1.93 . . . . 0.0 107.67 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 46.2 mt -74.68 131.42 40.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.798 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.3 m95 -118.89 127.48 53.53 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.344 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.5 t -93.16 101.45 13.74 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.318 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.777 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.9 t -93.86 102.5 13.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.663 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.18 142.03 27.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.335 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.28 103.93 0.39 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.14 1.893 . . . . 0.0 111.098 178.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.5 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.3 mm . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.299 -179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 . . . . . 0 CA--C 1.517 -0.29 0 CA-C-O 120.778 0.323 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.7 mt -79.95 122.91 27.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -110.67 157.23 19.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.105 0.479 . . . . 0.0 111.257 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 7.4 p -67.64 157.19 35.07 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.828 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 69.16 -2.2 1.89 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.793 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -73.95 139.81 45.13 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.443 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 16.8 tt0 -84.0 118.13 23.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.463 HG11 HD11 ' A' ' 69' ' ' LEU . 17.3 m -135.52 169.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.659 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -131.96 141.0 46.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 108.388 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.76 120.82 40.66 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.571 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -122.19 148.58 44.77 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.698 0.761 . . . . 0.0 112.323 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.514 ' SG ' HD22 ' A' ' 194' ' ' LEU . 27.1 t -136.45 147.45 47.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.492 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.0 m -88.99 123.49 33.36 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.552 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.665 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.42 120.86 41.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.094 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 m -126.51 133.32 51.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.766 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.522 HG23 ' CD2' ' A' ' 29' ' ' HIS . 18.4 tt -170.4 148.59 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.499 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 28' ' ' ILE . 48.4 m-70 58.4 40.26 24.42 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.908 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.05 22.16 12.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.594 179.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -126.21 145.75 50.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.456 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -131.12 149.02 52.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.905 0.383 . . . . 0.0 111.196 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -161.6 169.58 21.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -116.42 138.22 51.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.526 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.6 mt -128.06 139.44 52.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.705 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 48.0 t -104.61 142.63 34.31 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.632 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.3 tp -62.27 114.85 3.71 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.751 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.67 165.04 13.22 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.5 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.56 166.27 10.1 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.715 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.59 145.75 38.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.616 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.16 17.34 33.43 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.198 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -123.44 150.27 44.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.852 0.358 . . . . 0.0 110.621 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.18 -135.8 15.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.493 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -85.12 8.7 17.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.689 0.28 . . . . 0.0 111.083 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.465 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.52 29.24 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.293 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.4 ' H ' HD22 ' A' ' 44' ' ' ASN . 37.6 mt -77.26 139.33 39.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.019 0.438 . . . . 0.0 110.546 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.3 m -81.12 151.18 28.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.593 0.711 . . . . 0.0 111.119 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -144.85 -165.65 2.21 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.61 178.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.8 mt -130.64 140.7 50.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.386 0.613 . . . . 0.0 112.083 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.0 OUTLIER . . . . . 0 CA--C 1.504 -0.802 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.59 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.631 HD11 HG11 ' A' ' 21' ' ' VAL . 45.5 tp . . . . . 0 C--O 1.231 0.113 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.2 m -46.72 -55.76 7.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 26.9 pt -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.659 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.48 -3.27 43.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 0.0 111.262 -179.363 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.8 m -83.72 134.55 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.271 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.87 164.85 27.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.02 133.64 65.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.817 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.463 HD11 HG11 ' A' ' 20' ' ' VAL . 14.7 mt -82.85 65.01 7.76 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.3 mm-40 -44.55 -59.66 2.35 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.416 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.5 mm-40 -125.93 164.19 21.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.682 0.753 . . . . 0.0 112.897 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -156.18 84.77 1.0 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.993 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.0 mt -111.84 157.92 20.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.457 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -71.64 147.87 47.09 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.6 t -49.55 -44.12 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.095 0.474 . . . . 0.0 110.247 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -58.83 -50.08 75.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.98 97.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.828 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.81 -44.19 96.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.157 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 120.884 0.373 . . . . 0.0 110.462 179.805 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.79 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 20.9 mm-40 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.816 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.759 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 32.3 mtmm -86.61 -51.11 6.35 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 120.251 1.387 . . . . 0.0 111.326 -2.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -55.87 -40.52 73.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.847 -1.524 . . . . 0.0 112.881 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 20.8 tptm -58.18 -34.42 70.33 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.206 -179.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.79 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.0 t80 -73.44 -44.73 57.53 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 15.9 tpt -57.77 -34.37 69.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.216 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.5 mtp -73.22 -49.86 25.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -59.84 -34.69 73.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.646 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.9 m -72.65 -46.86 51.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.913 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.67 71.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.744 179.709 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.429 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 13.3 ptp180 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.974 0.416 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 174' ' ' LYS . 88.8 m -70.8 148.16 48.17 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.094 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 mp -82.19 131.33 35.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.514 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 74.5 mt -116.37 141.85 47.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.387 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.36 131.86 51.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.495 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.21 -10.37 61.62 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.178 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -85.83 140.24 30.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.072 0.463 . . . . 0.0 111.365 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.88 127.53 33.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.3 pt -111.91 161.77 10.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.521 0.677 . . . . 0.0 112.732 -178.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.416 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.7 tp -117.49 109.31 16.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.885 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.404 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.2 mt -96.67 118.11 32.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.768 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.467 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.6 ttp-105 -104.28 116.46 32.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.454 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.453 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.8 t-80 -58.82 107.44 0.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.3 t -49.79 -49.95 46.63 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -177.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 51.8 t80 -61.09 -67.25 0.42 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.423 ' OG ' HD13 ' A' ' 149' ' ' LEU . 56.0 p -68.22 -20.38 64.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.97 -0.85 71.02 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.252 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -82.67 -164.62 0.88 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.8 m-85 -133.95 138.26 45.36 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.6 tp -54.05 127.89 28.36 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 177.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.8 t -136.69 149.86 48.14 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -97.52 99.09 10.48 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.536 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 11.8 mt -75.9 153.5 36.66 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 54.4 m -84.01 9.95 11.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.954 -178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.2 p -94.03 124.81 38.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.84 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.394 0 CA-C-O 121.386 0.612 . . . . 0.0 112.071 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.536 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.0 m-85 -100.17 170.38 8.5 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.276 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -89.26 144.3 26.2 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -113.63 117.6 55.9 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.348 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.5 -147.08 5.52 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.899 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 59.0 mt -117.42 151.28 37.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.893 0.378 . . . . 0.0 110.774 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -141.69 142.97 33.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.886 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.54 -64.11 1.1 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.566 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -73.46 145.11 45.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.664 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 60.2 p -104.05 -5.13 22.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.947 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.3 p -54.71 111.84 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.527 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.84 -160.56 22.84 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.485 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.432 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -118.53 -12.29 9.81 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.803 0.335 . . . . 0.0 111.234 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.49 66.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 77.9 m -94.55 10.86 33.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -111.8 131.64 55.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.57 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.0 m95 -127.22 116.64 20.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.662 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 8.0 p -79.25 128.6 33.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.188 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.492 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.81 135.59 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 0.0 110.842 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.0 m80 -127.8 150.23 72.74 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.186 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.715 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.91 137.08 43.72 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.504 2.136 . . . . 0.0 112.297 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.01 -45.79 59.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.752 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.432 ' HB2' ' NE2' ' A' ' 168' ' ' GLN . 85.3 p -108.53 -175.59 2.82 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.262 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.74 14.83 14.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.139 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.432 ' NE2' ' HB2' ' A' ' 166' ' ' SER . 2.6 mp0 -88.21 -33.06 18.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.715 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.4 mmp_? -92.46 146.76 23.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.069 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 32.0 t -125.1 165.76 17.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.278 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.8 OUTLIER -65.83 131.63 46.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.488 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . 0.402 ' O ' HD22 ' A' ' 114' ' ' LEU . . . 93.95 -16.43 60.91 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.049 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.1 mt-10 -67.49 155.08 39.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.042 0.448 . . . . 0.0 111.205 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 112' ' ' THR . 73.8 mttt -71.16 142.68 50.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.602 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.492 HG21 HD12 ' A' ' 162' ' ' ILE . 95.4 t -93.74 112.0 25.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.148 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . 0.441 ' HD2' ' N ' ' A' ' 176' ' ' ARG . 1.2 mpt_? -78.58 154.83 30.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-O 121.388 0.614 . . . . 0.0 111.611 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 55.2 t -69.05 122.72 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.25 -12.69 36.93 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.076 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.26 126.29 29.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.787 0.327 . . . . 0.0 110.796 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.449 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 18.9 m-20 -69.49 114.77 8.03 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.476 HD21 HG13 ' A' ' 175' ' ' VAL . 60.4 mt -100.44 151.84 21.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.788 0.804 . . . . 0.0 112.998 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.465 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 57.2 mt -115.75 113.74 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 9.8 mp -93.48 135.32 34.84 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.201 0.525 . . . . 0.0 112.189 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.1 t -127.35 126.66 68.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.739 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.4 t -67.03 124.18 22.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.432 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 98.4 t -68.64 -32.72 56.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.946 0.403 . . . . 0.0 110.968 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.2 t -78.0 -37.62 46.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 p -117.63 7.76 12.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 46.34 31.95 1.4 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.49 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 36.1 mtt85 -112.42 142.3 45.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.842 0.353 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 63.6 m-85 -74.31 154.04 39.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.4 tp -76.09 76.95 2.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.404 -2.072 . . . . 0.0 105.404 175.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.403 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.3 t60 -76.89 150.23 36.03 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.514 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.4 tp -99.84 115.88 30.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 113.763 -1.562 . . . . 0.0 107.656 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 68.3 m -109.65 145.66 36.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -103.4 96.98 7.11 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 177.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.544 ' HA3' ' NE2' ' A' ' 202' ' ' HIS . . . -76.73 -167.03 25.67 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.04 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.461 ' C ' ' O ' ' A' ' 197' ' ' GLY . 4.4 p-10 -18.92 -63.03 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . 0.446 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 86.3 p -154.7 11.59 0.37 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.217 0.532 . . . . 0.0 109.612 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.1 t -127.04 179.02 5.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.832 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.665 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.5 m95 -106.24 135.76 47.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.297 0.57 . . . . 0.0 111.27 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.544 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 15.1 m-70 -128.45 174.02 9.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.863 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -128.14 132.43 68.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.308 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -149.82 168.0 24.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.662 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.498 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.7 96.79 9.63 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.75 179.45 3.95 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.386 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -87.2 8.41 24.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.186 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.403 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 16.5 mm-40 -117.23 136.68 52.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.724 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.405 HE21 ' HB2' ' A' ' 209' ' ' GLN . 17.8 mt-30 -65.23 174.7 1.94 Allowed 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 122.364 1.078 . . . . 0.0 113.007 -178.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.7 m -166.71 121.54 1.11 Allowed 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.99 -1.914 . . . . 0.0 107.798 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 51.2 mt -75.23 128.74 36.14 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.035 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.2 m95 -116.27 145.32 43.24 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.611 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 39.2 t -113.04 101.29 9.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.278 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 92.5 t -92.61 102.19 13.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.918 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.36 27.89 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.475 ' O ' HG12 ' A' ' 217' ' ' ILE . 22.8 Cg_exo -64.8 105.26 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.252 1.968 . . . . 0.0 111.484 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.49 HG23 HD21 ' A' ' 62' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.833 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 . . . . . 0 CA--C 1.517 -0.312 0 CA-C-O 120.898 0.38 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.4 mt -78.55 124.35 28.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -112.1 157.47 20.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.07 0.462 . . . . 0.0 110.952 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.2 p -67.64 155.38 39.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.863 179.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 71.02 -3.36 2.05 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.874 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -72.58 134.7 45.32 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.51 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -80.58 119.39 23.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.574 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.6 m -136.18 171.14 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.625 0.726 . . . . 0.0 112.948 -177.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.691 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.8 m -133.73 137.15 53.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.271 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.767 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.1 mp -97.73 121.77 40.04 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.613 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.46 ' HB2' ' OG ' ' A' ' 213' ' ' SER . 80.3 mt-30 -121.34 156.0 33.54 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.352 0.596 . . . . 0.0 111.538 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.529 ' SG ' HD22 ' A' ' 194' ' ' LEU . 21.5 t -143.7 144.48 31.88 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.368 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -86.14 124.98 33.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.445 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.36 119.53 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.034 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.2 m -122.46 139.38 53.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.781 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.2 tt -178.38 144.55 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.671 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.1 m80 59.11 41.15 21.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.318 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.3 20.98 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.626 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -127.81 134.28 49.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 110.672 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -124.02 146.22 48.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.056 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -156.21 171.62 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.857 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -117.87 136.37 53.5 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.464 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.07 143.02 51.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.44 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.612 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 50.9 t -107.64 142.67 37.24 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.649 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.3 tp -62.35 114.51 3.53 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.72 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.422 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -114.48 164.28 14.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.434 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 166.79 10.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.686 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.23 151.26 47.5 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.687 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.12 -6.92 87.66 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.624 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -107.82 163.07 13.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.11 -142.03 25.82 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.401 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.2 p30 -84.09 9.68 11.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 110.622 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.61 29.28 0.4 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.949 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.4 mt -79.37 139.17 37.82 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.97 0.414 . . . . 0.0 110.621 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.6 m -80.25 149.84 30.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.545 0.688 . . . . 0.0 111.131 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -144.17 -166.97 2.49 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.591 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.4 mt -129.79 141.43 50.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.336 0.588 . . . . 0.0 112.266 -178.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 mt-10 . . . . . 0 CA--C 1.502 -0.87 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.755 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.534 HD11 HG11 ' A' ' 21' ' ' VAL . 44.6 tp . . . . . 0 C--O 1.232 0.149 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.9 m -47.62 -54.88 10.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.422 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.0 pt -68.54 -16.9 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.691 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.01 -0.39 47.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.075 0.464 . . . . 0.0 111.305 -179.183 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.3 m -85.27 134.12 34.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.349 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -138.27 162.5 34.18 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.101 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.581 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.8 134.57 65.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.71 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 121' ' ' LEU . 16.4 mt -83.25 64.93 8.01 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.51 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.8 mm-40 -44.25 -62.9 1.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.408 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 56.7 mm-40 -122.91 163.08 21.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.705 0.764 . . . . 0.0 112.897 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -155.34 85.08 1.06 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.478 -1.237 . . . . 0.0 108.951 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.33 158.14 20.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.8 p -71.13 146.83 48.95 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -49.92 -45.72 22.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.083 0.468 . . . . 0.0 110.195 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.2 ttp85 -55.44 -54.24 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.454 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.31 95.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.821 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.4 tp -59.06 -44.55 91.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.281 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.893 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.809 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 3.2 mm-40 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.789 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.809 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 54.0 pttt -87.5 -50.98 6.18 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 120.372 1.442 . . . . 0.0 111.691 -3.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.413 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.7 p-90 -63.99 -28.8 70.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.948 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -61.8 -41.66 98.02 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.776 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.769 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.3 t80 -74.18 -45.17 50.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.123 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.4 ttp -56.57 -42.86 79.32 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.653 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.2 mmt -73.55 -40.07 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.163 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.51 -45.8 84.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.891 0.377 . . . . 0.0 110.626 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 52.4 p -70.09 -47.05 63.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.893 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.53 66.57 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.09 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.817 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.01 0.433 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.471 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 63.1 m -71.64 147.23 47.72 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.255 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.63 131.39 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.424 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.5 mt -115.58 141.58 47.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.291 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -61.98 129.58 41.58 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.983 0.42 . . . . 0.0 110.491 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.78 -13.14 57.88 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.051 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.49 140.89 33.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.04 0.448 . . . . 0.0 111.324 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.12 126.25 31.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.6 pt -112.06 158.26 12.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.527 0.679 . . . . 0.0 112.77 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 153' ' ' THR . 20.6 tp -114.26 109.97 19.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.966 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -97.0 116.48 29.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.688 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.581 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.9 ttp85 -102.85 117.11 33.91 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.795 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.1 t-80 -59.72 108.58 0.76 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.0 t -53.02 -45.31 67.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 53.7 t80 -65.16 -57.56 8.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.445 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.8 p -79.82 -15.39 57.51 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.63 -0.49 56.03 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.432 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.6 mtt -83.23 -165.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.466 0.175 . . . . 0.0 110.566 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 70.4 m-85 -134.09 138.11 45.06 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.472 HD13 HD21 ' A' ' 37' ' ' LEU . 23.0 tp -54.97 125.62 21.11 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -134.37 146.92 50.36 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 49.7 t -93.6 97.18 10.32 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -73.66 153.26 40.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.467 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.0 t -83.6 2.88 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.814 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 50.2 p -89.79 122.49 32.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.771 0.319 . . . . 0.0 110.909 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 57.5 m . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.747 179.815 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.7 m-85 -104.45 177.06 4.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.425 -1.261 . . . . 0.0 108.692 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -94.18 141.62 28.34 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 65.4 t -112.43 116.98 54.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.32 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.39 -147.9 5.8 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.758 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.445 HD13 ' OG ' ' A' ' 126' ' ' SER . 68.1 mt -116.74 151.89 35.46 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.87 0.366 . . . . 0.0 110.58 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.23 136.08 31.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.805 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -69.45 -46.84 65.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.15 147.75 25.48 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.754 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . 0.43 HG21 HD21 ' A' ' 120' ' ' LEU . 82.4 p -107.03 -7.6 16.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.62 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.6 p -53.87 116.78 2.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.502 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.21 -161.52 19.69 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.686 -0.769 . . . . 0.0 111.495 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.464 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.3 mt-10 -118.34 -15.19 9.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.741 0.305 . . . . 0.0 111.271 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.3 -32.17 68.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.126 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.3 m -88.15 4.5 45.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.478 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -109.8 135.35 50.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.044 0.449 . . . . 0.0 111.207 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.0 m95 -128.74 116.57 19.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.604 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.8 p -78.59 124.6 28.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.475 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.16 136.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.828 0.347 . . . . 0.0 110.936 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.45 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.06 150.03 72.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.618 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.8 Cg_endo -66.26 138.22 50.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.497 2.131 . . . . 0.0 112.483 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.18 -43.39 52.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.581 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 50.4 m -105.1 -170.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.286 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -92.44 -12.53 31.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -67.38 -35.48 79.41 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.318 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.2 mmt-85 -87.47 146.04 26.01 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.3 t -128.68 168.22 16.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.899 0.38 . . . . 0.0 111.411 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.71 132.28 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.151 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.56 -14.63 64.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.947 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -70.75 155.7 40.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.011 0.434 . . . . 0.0 111.258 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -71.53 144.13 49.71 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.48 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.481 HG13 HD21 ' A' ' 181' ' ' LEU . 80.0 t -94.84 111.14 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.409 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.89 154.54 35.95 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.399 0.618 . . . . 0.0 111.572 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.48 123.0 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.326 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -18.21 30.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -63.95 130.3 43.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.721 0.296 . . . . 0.0 110.739 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.619 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -72.34 115.31 11.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.481 HD21 HG13 ' A' ' 175' ' ' VAL . 66.8 mt -99.5 147.37 25.37 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.745 0.783 . . . . 0.0 112.911 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.45 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 58.4 mt -112.81 112.29 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.6 mp -92.49 136.67 33.01 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.943 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.466 HG22 ' CD1' ' A' ' 191' ' ' TYR . 83.4 t -130.46 125.51 59.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.793 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.9 m -61.2 129.0 39.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.464 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.3 t -72.54 -32.48 41.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.548 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 42.4 t -79.93 -37.28 34.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.526 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 50.5 m -114.07 0.5 14.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.18 27.59 3.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 179.466 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -108.14 142.41 38.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.03 0.443 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.2 m-85 -72.95 153.14 41.09 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.0 tp -75.76 74.86 2.73 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -74.2 150.17 40.5 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -174.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . 0.529 HD22 ' SG ' ' A' ' 24' ' ' CYS . 12.5 tp -99.82 116.22 31.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.522 176.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.412 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 45.3 t -110.05 147.8 32.9 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -177.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -107.64 89.76 3.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.75 -174.94 45.43 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.361 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 22.6 m-80 1.75 -79.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.435 0.694 . . . . 0.0 112.401 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 38.8 t -146.95 11.56 1.07 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.0 t -125.45 -179.17 4.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.752 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.24 136.08 47.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.27 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.467 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 27.9 m-70 -127.9 173.29 10.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.007 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.8 p -127.75 131.63 69.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.103 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.2 173.45 12.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.809 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.04 91.36 4.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.165 178.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -109.89 -179.82 3.91 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -88.18 7.7 30.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.214 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -116.51 137.33 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.608 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -64.73 175.44 1.46 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.399 1.095 . . . . 0.0 113.287 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -169.71 120.78 0.68 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.895 -1.957 . . . . 0.0 107.842 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.619 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 42.0 mt -74.47 132.8 42.21 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.937 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.414 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.9 m95 -121.31 118.24 29.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.489 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 23' ' ' GLN . 33.7 p -85.4 101.44 12.6 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.059 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.767 HG22 ' HG ' ' A' ' 22' ' ' LEU . 84.6 t -92.78 104.81 16.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.86 139.42 23.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.249 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 217' ' ' ILE . 33.1 Cg_exo -62.16 105.81 0.42 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.09 1.86 . . . . 0.0 111.266 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.574 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.156 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 120.791 0.329 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.3 mt -76.64 128.32 34.48 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 9.7 mmt85 -116.53 157.78 24.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.328 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.421 ' HG1' ' N ' ' A' ' 111' ' ' ARG . 10.7 p -68.29 155.51 39.59 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.748 179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.93 -8.26 1.31 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.441 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.0 m-20 -69.15 143.02 54.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 15.3 tt0 -89.57 116.29 27.61 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.537 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -132.54 175.65 10.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.687 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -135.15 142.03 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.575 176.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.772 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -103.53 117.91 35.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 42.5 mt-30 -118.97 149.94 40.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.674 0.75 . . . . 0.0 112.458 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.1 p -137.26 142.59 41.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.558 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.9 m -84.85 121.97 28.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.475 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.63 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -112.77 120.07 40.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.095 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 m -125.46 134.16 52.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.539 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -170.77 145.43 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.486 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.5 m80 58.26 39.12 25.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.793 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 61.45 25.61 15.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.258 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -127.33 133.47 50.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.282 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -122.64 148.71 44.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.474 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -161.85 173.1 15.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.553 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -120.53 136.54 54.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.569 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -125.78 141.03 52.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.533 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.645 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 51.4 t -104.75 146.23 29.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.491 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.502 HD21 HD13 ' A' ' 130' ' ' LEU . 31.9 tp -65.34 112.6 3.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.943 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.51 163.8 13.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.571 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.4 164.92 10.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.703 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.07 143.53 42.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.69 179.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.22 18.73 21.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.277 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -124.72 147.55 48.56 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.42 -138.75 20.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.485 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -80.51 7.56 9.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.734 0.302 . . . . 0.0 110.787 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.447 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.77 32.44 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.095 179.619 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -78.08 137.61 38.32 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 110.449 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -78.85 150.81 32.15 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.583 0.706 . . . . 0.0 111.449 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 p90 -145.21 -166.28 2.38 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.488 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.8 mt -129.09 142.51 50.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.403 0.62 . . . . 0.0 112.096 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 tt0 . . . . . 0 CA--C 1.503 -0.854 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.797 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 HG11 ' A' ' 21' ' ' VAL . 46.1 tp . . . . . 0 C--O 1.23 0.065 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.1 m -46.69 -54.0 10.53 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.464 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.9 pt -69.01 -18.71 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.687 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.87 -2.21 47.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.068 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.411 HG23 ' HG2' ' A' ' 19' ' ' GLU . 30.4 m -84.7 133.01 34.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.387 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.88 162.69 33.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.556 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -126.42 133.64 68.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.786 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 18' ' ' ASP . 15.0 mt -82.69 65.4 7.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.509 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.8 mm-40 -45.01 -61.22 1.71 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -124.57 164.66 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.651 0.739 . . . . 0.0 112.796 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 57.1 m -157.47 86.73 0.94 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.03 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.17 154.84 28.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.271 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.7 t -68.55 150.49 47.97 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -51.82 -43.51 34.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.078 0.466 . . . . 0.0 110.162 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HB3' ' NH1' ' A' ' 76' ' ' ARG . 18.4 ttp-105 -56.58 -57.13 13.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.912 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.61 89.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.091 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.6 tp -61.83 -46.49 89.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.256 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--N 1.324 -0.53 0 CA-C-O 120.958 0.409 . . . . 0.0 110.488 179.778 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.823 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.0 mm-40 . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 118.666 -0.683 . . . . 0.0 112.635 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.738 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 27.3 tttm -86.32 -50.86 6.62 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 125.469 1.508 . . . . 0.0 111.641 -2.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -57.53 -35.52 70.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.041 -1.436 . . . . 0.0 113.264 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.653 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 12.8 mmmm -64.18 -33.77 76.56 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.45 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.823 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 7.7 t80 -74.17 -49.43 23.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.224 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 50.0 ttm -59.45 -44.32 92.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.219 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.4 ttt -70.15 -49.25 52.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.534 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.8 -38.4 75.45 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.047 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 -46.77 57.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.83 -54.35 48.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.572 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.087 -179.648 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.421 ' N ' ' HG1' ' A' ' 16' ' ' THR . 14.8 ptm180 . . . . . 0 N--CA 1.458 -0.068 0 CA-C-O 120.886 0.374 . . . . 0.0 111.019 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 84.4 m -78.98 144.28 34.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.411 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.09 130.39 35.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.4 mt -115.15 142.36 46.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.332 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.11 130.74 46.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.044 0.45 . . . . 0.0 110.529 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.6 -13.04 59.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.069 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -83.05 140.02 32.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.022 0.439 . . . . 0.0 111.456 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.99 128.18 33.82 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.5 pt -112.65 159.72 12.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.649 0.738 . . . . 0.0 112.935 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.4 tp -115.66 107.19 14.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.686 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.406 ' CD2' HD23 ' A' ' 69' ' ' LEU . 47.1 mt -95.37 117.62 30.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.74 -178.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 68' ' ' VAL . 62.3 ttp85 -104.04 116.04 31.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.696 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.6 t-80 -57.69 110.71 0.94 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.9 t -52.76 -52.46 56.42 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 48.6 t80 -57.73 -66.9 0.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.0 p -66.72 -33.06 74.81 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.02 -3.11 80.44 Favored Glycine 0 C--N 1.322 -0.204 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.676 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.3 mtt -81.94 -165.5 1.0 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.716 -0.242 . . . . 0.0 110.434 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.496 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.7 m-85 -133.46 139.25 46.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.502 HD13 HD21 ' A' ' 37' ' ' LEU . 26.0 tp -54.66 127.14 26.77 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.8 t -136.5 143.99 44.07 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -91.82 97.83 11.23 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.511 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.5 mt -73.76 145.31 45.18 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.522 -178.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.5 p -76.71 -0.04 22.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.757 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.6 p -91.25 120.44 32.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 110.94 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 49.4 m . . . . . 0 C--N 1.324 -0.523 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.779 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.516 0.674 . . . . 0.0 112.139 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 14.5 m-85 -103.85 172.72 6.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.995 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.26 144.63 25.67 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 120.995 0.426 . . . . 0.0 109.867 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 74.8 t -114.13 117.9 56.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.288 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.84 -150.44 5.81 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.008 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.447 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 65.7 mt -114.89 151.96 33.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.925 0.393 . . . . 0.0 110.776 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -140.14 142.76 35.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.859 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.61 -51.62 11.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.529 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -83.27 146.25 28.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.0 p -106.54 -7.72 17.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 65.8 p -54.73 114.07 1.56 Allowed 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.49 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.06 -160.06 21.84 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.706 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.427 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.6 mt-10 -118.85 -14.85 9.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.745 0.307 . . . . 0.0 111.429 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.3 -34.35 66.41 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.4 m -89.51 8.01 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -111.02 133.51 53.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.104 0.478 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.3 m95 -128.13 115.98 19.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.741 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 13.5 p -78.35 126.36 30.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.208 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.38 136.18 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.421 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.4 m80 -129.25 151.47 77.84 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.187 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.67 140.16 55.47 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.593 2.195 . . . . 0.0 112.397 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.73 51.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.746 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 7.7 t -110.79 -168.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.441 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -95.57 4.75 52.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.333 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -84.04 -30.65 25.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.905 0.383 . . . . 0.0 111.004 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.0 mmt-85 -92.27 144.23 25.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.7 m -124.94 164.79 19.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.935 0.397 . . . . 0.0 111.64 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . 0.465 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.69 130.64 43.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.317 179.427 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.7 -16.95 60.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.027 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -67.79 156.18 37.62 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.952 0.406 . . . . 0.0 111.093 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -72.23 144.67 48.37 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.507 HG13 HD21 ' A' ' 181' ' ' LEU . 95.5 t -94.68 113.23 28.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -77.0 155.0 32.91 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.649 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 216' ' ' PRO . 22.8 t -69.93 119.91 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 176.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.94 -13.76 31.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.309 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -66.38 132.48 48.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.813 0.339 . . . . 0.0 110.932 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.511 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.2 m-20 -73.49 110.46 7.8 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.747 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.507 HD21 HG13 ' A' ' 175' ' ' VAL . 56.6 mt -97.34 150.64 20.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.748 0.785 . . . . 0.0 112.985 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.501 HD13 ' NE2' ' A' ' 209' ' ' GLN . 48.0 mt -115.61 113.07 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 176.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.64 136.37 33.28 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.028 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.469 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.1 t -128.47 127.61 67.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.812 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 6.6 m -65.3 125.08 23.95 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.427 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.1 t -69.54 -30.36 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.963 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 94.1 p -79.94 -37.0 35.42 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.403 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 73.9 p -120.2 9.31 11.06 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 46.26 31.96 1.37 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.386 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 24.2 mtt180 -111.05 140.42 45.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.085 0.469 . . . . 0.0 110.983 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.5 m-85 -72.84 153.61 40.98 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.6 tp -75.57 75.93 2.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 175.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.26 151.07 38.41 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 115.68 1.734 . . . . 0.0 115.68 -174.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.2 tp -100.42 117.45 34.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.585 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 34.1 t -112.03 146.03 38.63 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -105.32 92.67 4.3 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.531 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -173.85 44.76 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.375 -0.916 . . . . 0.0 111.419 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.531 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.1 m120 -3.28 -76.3 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.362 0.665 . . . . 0.0 112.51 -179.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 78.2 p -147.7 13.72 1.05 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.116 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.1 t -128.42 179.45 5.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.63 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.9 m95 -106.07 136.45 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.219 0.533 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.516 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 23.0 m-70 -128.19 173.11 10.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.029 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.7 p -127.57 131.06 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.146 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -147.52 173.11 12.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.683 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.22 93.91 5.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.152 178.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.98 176.86 4.84 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.304 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -85.69 10.11 14.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.072 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -118.09 134.59 54.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.501 ' NE2' HD13 ' A' ' 182' ' ' ILE . 95.4 mt-30 -63.62 174.7 1.27 Allowed 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 122.389 1.09 . . . . 0.0 113.133 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.4 m -167.52 120.82 0.94 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.939 -1.937 . . . . 0.0 107.734 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.511 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.6 mt -74.53 128.76 36.34 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.004 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -115.78 147.31 41.1 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.498 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.3 t -113.62 98.57 7.14 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.326 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.1 t -91.63 100.45 11.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -117.6 135.79 23.39 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.481 ' HA ' HG12 ' A' ' 20' ' ' VAL . 17.5 Cg_endo -60.07 107.14 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 121.835 1.69 . . . . 0.0 111.135 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.537 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.6 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.121 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 . . . . . 0 CA--C 1.515 -0.385 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 25.4 mt -80.53 121.94 26.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -110.96 157.89 19.39 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.09 0.472 . . . . 0.0 111.287 -179.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 p -67.62 156.2 37.38 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.661 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 71.58 -4.25 1.93 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.818 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 2.9 m-20 -73.15 133.01 43.94 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.691 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.84 121.36 25.86 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.7 m -136.93 173.93 12.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -135.62 136.76 50.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.251 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -97.49 122.92 41.1 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.672 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 38.6 mt-30 -122.84 149.29 44.37 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 112.029 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -136.18 144.07 44.76 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.627 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.4 m -86.72 122.06 30.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.04 120.51 41.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.065 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.8 m -124.15 132.29 53.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.039 0.447 . . . . 0.0 111.761 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.1 tt -169.3 146.0 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.507 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 m80 59.79 39.66 20.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.7 mppt? 61.3 21.52 12.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.372 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -124.94 144.66 50.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -131.5 146.33 52.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.978 0.418 . . . . 0.0 111.384 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.403 HE21 ' HB2' ' A' ' 33' ' ' GLN . 2.2 pt20 -157.38 170.25 22.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.604 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -118.42 137.25 53.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.569 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -125.71 143.68 50.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.601 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.4 p -107.94 139.72 42.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 0.0 110.435 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.4 tp -60.23 109.81 1.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.008 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.498 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.06 164.34 12.51 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.6 -179.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.16 162.03 10.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.766 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.95 142.83 44.63 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.557 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.22 23.17 8.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.366 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -130.57 147.12 52.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.872 0.367 . . . . 0.0 110.561 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.57 -125.34 6.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.519 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.422 ' HA ' HD22 ' A' ' 44' ' ' ASN . 1.5 t-20 -93.56 8.02 42.35 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.749 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.16 31.88 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.296 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 46' ' ' LEU . 17.5 mt -80.41 134.39 36.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.602 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.53 149.72 38.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.65 0.738 . . . . 0.0 111.163 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -146.07 -166.09 2.37 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.265 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 37' ' ' LEU . 24.7 mt -128.94 145.19 51.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.386 0.613 . . . . 0.0 111.736 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 tt0 . . . . . 0 CA--C 1.5 -0.951 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.767 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.642 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp . . . . . 0 C--O 1.232 0.14 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.4 m -49.73 -51.76 36.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.498 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.8 pt -67.38 -18.4 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -178.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 58.4 m -100.63 14.15 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.652 0.263 . . . . 0.0 111.334 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -91.86 129.82 37.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -136.93 158.7 43.85 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.138 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 t -122.8 132.7 70.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.694 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.73 67.59 6.66 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 178.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 12.1 mm-40 -46.81 -63.99 0.88 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.426 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.5 mm100 -123.01 162.08 23.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.712 0.768 . . . . 0.0 112.922 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.5 p -153.59 86.2 1.2 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.919 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -115.8 157.03 25.0 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.661 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.2 t -70.02 150.74 46.32 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.8 t -52.84 -42.87 44.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.899 0.38 . . . . 0.0 110.323 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.1 ttp-105 -58.92 -56.87 16.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.87 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.53 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.81 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.4 -44.63 94.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.119 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 . . . . . 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 0.0 110.52 179.908 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.78 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.454 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.78 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 9.4 mtmp? -88.63 -51.82 5.48 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 125.008 1.323 . . . . 0.0 111.038 -3.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -64.85 -28.57 69.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.676 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 41.4 ttmt -61.15 -41.66 97.15 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.634 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.615 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 53.3 t80 -73.84 -45.67 49.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.958 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.3 ttt -56.63 -39.03 72.94 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.759 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 mmt -74.06 -45.65 48.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.138 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.44 -40.99 79.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.755 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.2 p -72.93 -45.65 56.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.299 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.42 -46.46 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.274 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.665 179.764 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 . . . . . 0 N--CA 1.457 -0.084 0 CA-C-O 121.069 0.462 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . 0.507 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 86.5 m -79.11 146.49 33.18 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.0 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.41 131.63 35.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.576 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.96 142.91 46.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.297 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.89 129.8 42.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.119 0.485 . . . . 0.0 110.443 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -13.3 58.1 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.197 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.65 139.91 33.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.456 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.6 127.25 32.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.26 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -111.87 159.71 11.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.606 0.717 . . . . 0.0 112.789 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.426 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -115.39 109.18 17.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.935 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.416 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.12 118.41 33.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.675 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.485 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 15.8 ttp-105 -104.24 116.59 32.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.67 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.2 t-80 -59.78 106.75 0.52 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -51.49 -44.71 62.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -177.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 26.2 t80 -65.6 -59.17 4.23 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 149' ' ' LEU . 59.8 p -78.2 -14.49 59.43 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 73.42 0.87 55.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.383 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -84.58 -164.79 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.441 0.162 . . . . 0.0 110.64 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.423 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.1 m-85 -134.85 138.8 44.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.439 HD13 HD21 ' A' ' 37' ' ' LEU . 24.5 tp -55.97 124.8 18.92 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.593 ' SG ' HD21 ' A' ' 133' ' ' LEU . 19.3 p -134.5 147.72 50.4 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.4 t -93.76 98.52 11.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.643 -1.162 . . . . 0.0 107.891 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.593 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.1 mt -75.7 149.67 38.04 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.283 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.7 t -80.63 4.56 18.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.861 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 79.8 p -93.5 118.87 31.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.755 0.312 . . . . 0.0 111.263 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 48.4 t . . . . . 0 C--N 1.324 -0.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.251 179.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 121.518 0.675 . . . . 0.0 112.44 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.534 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 11.0 m-85 -103.32 171.62 7.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.907 177.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -91.01 144.05 26.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.72 118.53 58.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.242 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.21 -150.48 5.9 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.148 -1.025 . . . . 0.0 113.172 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 81.0 mt -116.55 143.63 45.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.051 0.453 . . . . 0.0 110.832 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 1.8 tp60 -131.74 140.82 49.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.583 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.6 -51.49 19.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.509 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.468 ' HB3' HG22 ' A' ' 154' ' ' THR . 10.0 m-20 -84.61 152.17 24.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.541 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.7 p -107.86 -3.93 18.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.731 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . 0.468 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.45 117.68 3.27 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.602 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 121.93 -161.29 16.11 Favored Glycine 0 N--CA 1.441 -0.992 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.829 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.528 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -118.89 -12.21 9.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.707 0.289 . . . . 0.0 111.23 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.34 -31.87 67.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.5 m -89.6 6.85 39.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.655 0.264 . . . . 0.0 111.503 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.9 131.8 54.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.08 0.467 . . . . 0.0 111.305 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.462 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.5 m95 -127.14 115.27 18.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.711 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.5 p -78.13 126.24 30.52 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.152 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.462 HD12 HG21 ' A' ' 175' ' ' VAL . 2.4 pt -87.57 135.19 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 0.0 110.794 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.407 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 72.8 m80 -127.86 149.35 70.43 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.202 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.651 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.4 Cg_endo -65.4 136.69 47.97 Favored 'Trans proline' 0 CA--C 1.517 -0.341 0 C-N-CA 122.502 2.135 . . . . 0.0 112.323 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.423 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.08 -39.55 49.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.396 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 79.0 p -104.85 -173.12 2.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.516 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -94.11 -7.09 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.931 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.445 ' HB2' ' NH1' ' A' ' 169' ' ' ARG . 2.3 mm100 -73.78 -34.03 64.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.092 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.651 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 69.7 mmt-85 -87.97 145.13 26.16 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.829 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.1 t -127.13 167.97 15.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.459 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.23 133.58 50.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.254 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.35 -16.99 58.55 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.132 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -68.04 156.33 37.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.916 0.389 . . . . 0.0 111.103 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.27 145.47 47.87 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.462 HG13 HD21 ' A' ' 181' ' ' LEU . 91.1 t -95.11 112.38 27.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.94 0.4 . . . . 0.0 110.263 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -77.62 154.56 32.13 Favored 'General case' 0 CA--C 1.5 -0.954 0 CA-C-O 121.353 0.597 . . . . 0.0 111.595 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 45.7 t -70.53 122.14 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.89 -13.3 32.01 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.963 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -70.16 130.13 41.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.73 0.3 . . . . 0.0 110.741 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.486 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 10.4 m-20 -73.51 115.24 12.67 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.462 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -99.84 149.79 23.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.818 0.818 . . . . 0.0 113.122 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.512 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.5 mt -114.26 113.17 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.84 136.87 32.86 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.175 0.512 . . . . 0.0 112.227 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.471 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.3 t -128.77 125.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.764 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 34.5 t -65.19 123.92 20.81 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.4 t -67.44 -33.53 62.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.74 -39.54 35.92 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 65.3 m -113.35 6.94 17.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.25 32.19 0.93 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 27.6 mtt180 -114.32 141.31 47.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.918 0.39 . . . . 0.0 110.73 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.0 m-85 -72.24 153.54 41.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.25 76.8 2.37 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.407 -2.072 . . . . 0.0 105.407 175.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -76.57 151.31 36.35 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -174.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.8 tp -100.64 117.3 34.48 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.672 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.429 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 42.7 t -111.23 146.33 37.14 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.86 90.31 3.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.12 -174.53 40.77 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.464 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 71.4 m-20 -2.12 -76.62 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.42 0.688 . . . . 0.0 112.594 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 39.7 t -147.62 12.68 1.03 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.05 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.8 p -127.25 -179.86 5.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.1 m95 -107.22 135.92 47.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.207 0.527 . . . . 0.0 111.198 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.484 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 24.3 m-70 -127.74 173.1 10.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.108 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.86 131.98 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.104 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -149.33 172.44 14.89 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.66 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.14 94.54 6.56 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.259 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.21 174.83 5.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.129 -177.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -83.76 9.37 12.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.038 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 13.7 mm100 -115.35 136.85 52.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.534 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.512 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.8 mt-30 -66.29 175.31 2.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 122.295 1.045 . . . . 0.0 113.047 -178.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.9 m -167.98 120.82 0.88 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 113.025 -1.898 . . . . 0.0 107.891 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 37.1 mt -74.74 127.59 33.52 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.976 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.413 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -114.71 146.75 40.56 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.617 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.2 m -113.76 100.04 8.16 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.222 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 22' ' ' LEU . 75.0 t -91.31 99.95 10.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.818 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.0 139.38 22.89 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.122 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.477 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.8 Cg_exo -63.6 106.94 0.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.018 1.812 . . . . 0.0 111.197 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.3 mm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.976 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.477 ' CD1' ' HD2' ' A' ' 176' ' ' ARG . 40.5 m-85 . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 120.907 0.384 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.8 mt -81.36 123.64 28.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -111.04 156.57 21.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.939 0.399 . . . . 0.0 111.069 -179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.8 p -67.19 155.65 38.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.844 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.43 -8.3 1.38 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.77 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -69.05 132.27 46.35 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.913 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -79.29 123.03 27.07 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.484 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.0 m -138.23 169.78 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.678 ' HB ' ' SG ' ' A' ' 36' ' ' CYS . 2.5 m -132.74 136.19 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.335 176.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.716 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.19 126.09 42.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.808 0.337 . . . . 0.0 110.918 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 44.1 mt-30 -125.14 151.06 46.26 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.488 0.661 . . . . 0.0 111.787 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -137.63 144.12 41.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.541 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.7 m -86.12 122.03 29.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.327 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.615 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.07 121.99 44.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.144 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.2 m -125.63 137.66 53.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.991 0.424 . . . . 0.0 111.616 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.0 tt -174.16 143.32 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.582 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 43.5 m80 59.64 39.34 21.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.005 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.429 ' N ' ' HE2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.4 22.6 13.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.378 179.589 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -126.67 129.09 47.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.612 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -119.61 145.85 46.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.26 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -156.74 174.3 15.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.683 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -121.41 135.88 55.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.478 178.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.484 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -123.69 143.88 49.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.72 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.678 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 4.3 t -107.11 135.05 49.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.977 0.418 . . . . 0.0 110.56 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.9 tp -59.89 103.3 0.2 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.882 179.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -101.56 164.61 11.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.634 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.59 158.63 11.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.545 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -131.09 150.09 52.31 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.75 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.07 -4.25 89.99 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.918 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -109.04 161.55 15.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.891 0.377 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.69 -141.63 24.76 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.294 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.437 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -84.38 11.86 7.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.776 0.322 . . . . 0.0 110.641 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.14 30.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.437 ' H ' HD22 ' A' ' 44' ' ' ASN . 53.6 mt -79.59 135.83 36.69 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.7 m -76.75 150.84 36.19 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.304 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -144.89 -170.29 3.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.706 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.6 mt -127.4 143.04 51.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.313 0.578 . . . . 0.0 112.141 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' CD ' HD11 ' A' ' 64' ' ' ILE . 0.9 OUTLIER . . . . . 0 CA--C 1.502 -0.882 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.662 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HG11 ' A' ' 21' ' ' VAL . 43.3 tp . . . . . 0 N--CA 1.456 -0.141 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.6 m -54.72 -40.01 68.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 38' ' ' ALA . 21.0 pt -71.66 -16.86 19.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -178.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 37' ' ' LEU . 16.6 t -105.59 4.8 30.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.247 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.1 m -76.24 125.92 30.05 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.2 161.18 35.63 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.8 t -125.11 133.19 70.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.673 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.1 mt -80.7 66.19 6.13 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.7 mm-40 -45.75 -61.39 1.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 55.5 mm-40 -124.37 164.36 19.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.662 0.744 . . . . 0.0 112.816 -177.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.0 t -156.43 84.51 0.98 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.829 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.1 153.23 29.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.489 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.9 p -67.27 148.61 51.49 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.9 t -50.33 -42.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.976 0.417 . . . . 0.0 110.264 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.4 ttp85 -59.67 -50.47 73.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.14 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.03 99.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.755 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.33 -46.05 88.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.182 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 120.971 0.415 . . . . 0.0 110.583 179.892 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.826 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 7.7 mm-40 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.826 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 51.6 mtmt -86.33 -51.59 6.15 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 120.353 1.433 . . . . 0.0 111.898 -2.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -60.51 -37.35 80.84 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.977 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.622 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 52.5 mttp -57.9 -38.03 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.276 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.821 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.1 t80 -74.04 -44.38 54.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.916 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.6 ttt -57.15 -37.95 72.82 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.431 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.3 mmt -72.36 -43.7 63.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.372 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -62.06 -34.53 76.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.585 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.4 m -72.92 -49.05 31.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.279 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.98 44.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.391 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.291 -179.701 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.276 0.56 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 92.2 m -75.47 146.0 40.99 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.139 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.33 134.33 36.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.1 mt -117.64 142.06 47.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.864 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -61.67 127.96 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.67 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.45 -9.43 55.83 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.968 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -85.39 139.42 31.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 111.079 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.26 127.14 32.38 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.8 pt -112.12 157.7 12.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.587 0.708 . . . . 0.0 112.854 -178.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.411 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -113.26 109.08 18.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.936 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.1 mt -97.06 117.71 31.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.554 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.2 ttp85 -104.22 117.79 35.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.689 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.4 t-80 -60.02 105.45 0.4 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 177.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 45.7 t -46.5 -53.91 10.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.415 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.1 t80 -58.12 -71.48 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.402 ' OG ' HD13 ' A' ' 149' ' ' LEU . 77.9 p -62.21 -25.05 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . 0.513 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 81.87 -0.82 87.93 Favored Glycine 0 C--N 1.322 -0.234 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.288 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 45.9 mtt -83.03 -164.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.489 0.185 . . . . 0.0 110.673 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.456 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.0 m-85 -135.61 139.28 43.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.56 126.1 23.86 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.7 t -136.06 147.97 48.12 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.8 t -94.42 99.07 11.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.8 mt -77.37 146.0 36.93 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.624 -178.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -0.12 17.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.932 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.2 p -88.87 121.6 31.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.72 0.295 . . . . 0.0 110.974 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 42.0 t . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.712 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.444 -0.747 0 CA-C-O 121.221 0.534 . . . . 0.0 111.573 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 10.5 m-85 -99.49 170.49 8.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.141 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -90.15 143.14 27.04 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.86 116.76 53.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.275 178.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.05 -151.85 6.56 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.881 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 68.7 mt -113.89 147.0 39.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.81 0.338 . . . . 0.0 110.561 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -136.69 140.79 42.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.099 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -74.16 -47.94 32.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.594 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -84.99 146.89 26.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.1 p -107.98 -10.26 15.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.99 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.1 p -54.52 112.37 0.99 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.355 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 131.87 -158.44 22.86 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.341 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.473 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.2 mt-10 -121.8 -14.43 8.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.717 0.294 . . . . 0.0 111.24 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . 0.423 ' N ' ' HB2' ' A' ' 187' ' ' SER . . . -57.61 -32.79 67.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.174 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.3 m -89.45 5.97 42.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.604 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -110.19 132.56 54.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.111 0.481 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.452 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.47 117.18 21.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.649 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 7.7 p -79.13 128.01 32.75 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.133 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.553 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.26 134.33 28.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . 0.478 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 69.8 m80 -127.96 151.85 76.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.291 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.666 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.6 Cg_endo -68.78 137.45 38.47 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.504 2.136 . . . . 0.0 112.291 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.415 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.45 -40.41 43.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.438 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.1 p -105.52 -171.12 1.85 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.499 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -95.51 -0.94 51.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.0 -36.06 49.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.989 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.666 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.2 mmp_? -87.57 149.45 24.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.525 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 47.7 t -131.75 161.74 32.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.017 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.27 126.75 29.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.137 179.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.61 -14.91 57.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.688 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.79 156.57 38.77 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -72.93 136.85 45.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.372 178.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.553 HG21 HD12 ' A' ' 162' ' ' ILE . 84.3 t -85.57 119.29 33.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.378 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . 0.477 ' HD2' ' CD1' ' A' ' 13' ' ' PHE . 11.0 mmm180 -84.6 153.99 22.86 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-O 121.364 0.602 . . . . 0.0 111.513 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.423 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.9 t -69.66 122.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.28 -8.3 38.05 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.295 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -73.09 131.44 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.742 0.306 . . . . 0.0 110.9 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.514 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 24.5 m-20 -72.57 110.97 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 69.0 mt -97.51 149.68 21.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . 0.505 HD13 ' NE2' ' A' ' 209' ' ' GLN . 54.4 mt -114.41 113.17 42.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.13 138.6 31.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.101 0.477 . . . . 0.0 112.069 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.451 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.5 t -130.21 123.66 56.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.81 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 189' ' ' GLU . 87.5 p -65.23 119.15 10.37 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.1 t -63.17 -31.86 54.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.19 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . 0.423 ' HB2' ' N ' ' A' ' 157' ' ' ALA . 44.2 t -77.49 -39.2 47.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -178.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 m -116.66 9.89 14.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 185' ' ' SER . 0.4 OUTLIER 44.38 32.93 0.78 Allowed 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.584 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 29.0 mtt180 -113.31 140.27 48.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.95 0.405 . . . . 0.0 110.815 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -72.17 153.62 41.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 31.1 tp -74.82 76.54 2.11 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 175.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -75.98 150.03 37.51 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.3 tp -100.14 116.53 32.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.602 177.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 49.2 p -110.1 145.39 37.22 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -105.82 91.05 3.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.15 178.83 53.43 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.032 179.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.517 ' C ' ' O ' ' A' ' 197' ' ' GLY . 54.5 m-20 9.55 -82.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.326 0.651 . . . . 0.0 112.51 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 47.5 t -143.08 4.11 1.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.527 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.4 p -119.89 -179.35 3.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.195 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.615 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -105.83 139.12 40.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.249 0.547 . . . . 0.0 111.341 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.449 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 32.7 m-70 -130.41 172.5 11.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.073 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.26 133.89 67.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.223 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -151.96 170.96 18.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.662 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.48 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -97.61 96.53 8.35 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.97 174.8 5.84 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.113 -177.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -83.57 11.11 7.6 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.051 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 23.1 mt-30 -117.63 135.76 53.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.441 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.505 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.0 mt-30 -65.56 175.23 1.89 Allowed 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 122.31 1.052 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.4 m -168.62 120.82 0.8 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.084 -1.871 . . . . 0.0 107.836 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 27.9 mt -74.88 129.11 37.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.077 0.465 . . . . 0.0 109.85 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.0 m95 -116.06 146.74 41.95 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.632 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 45.7 t -113.7 101.77 9.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.133 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.716 HG22 ' HG ' ' A' ' 22' ' ' LEU . 79.3 t -92.88 101.78 12.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.779 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.84 140.3 23.87 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.2 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.423 ' HD3' HG13 ' A' ' 177' ' ' VAL . 24.0 Cg_exo -63.74 104.03 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 121.975 1.783 . . . . 0.0 110.984 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 62' ' ' LEU . 3.8 mm . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.383 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 120.844 0.354 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.0 mt -82.51 121.67 27.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.442 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.26 157.16 19.1 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.012 0.434 . . . . 0.0 111.086 -179.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.402 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.6 p -68.27 156.63 37.28 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.45 -8.94 1.11 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.701 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.442 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.8 m-20 -67.91 135.35 52.33 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -82.0 118.05 22.69 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.504 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.2 m -134.83 172.62 15.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.666 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -134.91 139.31 47.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.2 176.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.796 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.5 mp -100.0 120.93 40.59 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.689 0.281 . . . . 0.0 110.662 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.441 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 24.2 mt-30 -118.19 160.19 22.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.438 0.637 . . . . 0.0 111.793 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -146.76 143.61 28.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.319 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -88.04 121.59 30.63 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.054 0.454 . . . . 0.0 110.405 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.617 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.0 121.72 45.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.978 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 m -126.22 130.09 50.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.986 0.422 . . . . 0.0 111.86 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.8 tt -168.74 149.23 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.51 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 44.0 m80 59.28 39.32 22.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.11 23.67 13.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -127.77 147.17 50.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.455 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -131.75 148.78 52.6 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.967 0.413 . . . . 0.0 111.028 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -161.67 165.28 28.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.672 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -113.32 135.22 54.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.428 178.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.3 mt -124.69 142.33 51.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.728 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.601 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 47.6 t -106.36 145.58 31.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.4 . . . . 0.0 110.588 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 130' ' ' LEU . 33.4 tp -65.32 114.59 4.87 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.585 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.492 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -113.8 164.61 13.52 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.417 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.434 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -169.02 161.1 10.4 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.594 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.67 144.17 51.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.724 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.8 -9.23 86.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.775 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -106.01 162.87 13.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 111.146 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.97 -142.5 26.52 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.477 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 19.6 p30 -83.02 9.71 9.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.747 0.308 . . . . 0.0 110.833 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.29 0.38 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.177 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.2 mt -79.44 137.59 37.3 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.938 0.399 . . . . 0.0 110.487 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.4 m -77.91 153.89 32.17 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.634 0.73 . . . . 0.0 111.524 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -148.34 -166.11 2.45 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.319 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 37' ' ' LEU . 25.5 mt -130.44 143.89 51.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.299 0.571 . . . . 0.0 112.429 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 mt-10 . . . . . 0 CA--C 1.503 -0.859 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.594 179.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.575 HD11 HG11 ' A' ' 21' ' ' VAL . 45.2 tp . . . . . 0 C--O 1.231 0.094 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.2 p -45.26 -56.63 4.66 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.492 HD12 ' HB1' ' A' ' 38' ' ' ALA . 30.4 pt -67.98 -18.24 23.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.666 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.59 -3.29 46.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.917 0.389 . . . . 0.0 111.679 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.459 HG22 ' OG ' ' A' ' 124' ' ' SER . 23.0 m -83.66 134.74 34.77 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -138.82 163.62 31.77 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 t -127.61 133.83 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.408 HD11 HG11 ' A' ' 20' ' ' VAL . 20.5 mt -82.45 65.33 7.53 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.8 mm-40 -45.22 -66.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.498 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 20.0 mm-40 -119.25 166.61 12.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.743 0.783 . . . . 0.0 113.1 -177.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.4 t -159.62 82.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.402 -1.272 . . . . 0.0 108.746 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.9 mt -111.6 157.11 20.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.388 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 t -69.13 150.04 47.99 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 41.3 t -52.88 -42.94 44.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.06 0.457 . . . . 0.0 110.18 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -59.24 -51.74 68.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.25 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.15 98.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.721 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.81 -44.32 96.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.001 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 . . . . . 0 C--N 1.323 -0.552 0 CA-C-O 120.911 0.386 . . . . 0.0 110.645 179.864 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.759 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 15.3 mm-40 . . . . . 0 CA--C 1.534 0.35 0 CA-C-O 118.644 -0.694 . . . . 0.0 112.74 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.725 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 46.9 mtmt -86.27 -49.81 7.42 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 0.0 110.881 -2.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.432 ' O ' ' HG2' ' A' ' 102' ' ' MET . 49.0 t90 -53.97 -43.66 70.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.651 -178.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.612 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -58.37 -30.3 66.68 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.153 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.759 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 9.8 t80 -73.87 -47.52 37.59 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.523 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 14.9 tpt -56.71 -38.62 72.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.603 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 98' ' ' TRP . 91.2 mmm -72.74 -43.37 63.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -57.45 -40.01 77.53 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.474 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 74.1 p -72.45 -46.83 53.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.97 -26.61 67.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.894 179.862 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.402 ' N ' ' HG1' ' A' ' 16' ' ' THR . 14.4 ptm180 . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.913 0.387 . . . . 0.0 111.124 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.7 m -75.8 146.7 39.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.287 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.2 131.68 35.31 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.768 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -116.04 141.98 47.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.244 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.58 129.13 39.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.451 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.16 -13.43 57.24 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.951 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.37 141.93 32.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.053 0.454 . . . . 0.0 111.303 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.74 125.22 31.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.3 pt -110.31 160.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.528 HD21 HG21 ' A' ' 153' ' ' THR . 20.0 tp -116.84 111.62 19.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.036 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.402 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.7 mt -98.82 117.69 33.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 17.2 ttp-105 -103.24 115.53 30.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.763 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.9 t-80 -58.18 108.19 0.57 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.459 ' OG ' HG22 ' A' ' 66' ' ' THR . 44.0 m -52.82 -46.27 67.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 60.4 t80 -63.33 -59.28 4.92 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 t -78.27 -17.0 57.24 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.67 -2.33 59.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.552 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 62.3 mtm -84.13 -167.11 1.63 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.463 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 63.5 m-85 -130.93 139.0 50.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 37' ' ' LEU . 30.3 tp -54.87 128.69 34.32 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 46.2 t -137.72 147.78 45.07 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.5 t -95.07 98.38 10.62 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.8 mt -75.33 153.43 37.86 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.618 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.0 t -80.66 -4.59 54.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.769 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 32.4 p -83.95 122.01 28.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.728 0.299 . . . . 0.0 111.131 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 50.8 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 121.312 0.577 . . . . 0.0 111.641 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.496 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 15.6 m-85 -101.61 172.22 7.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.143 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -90.52 145.13 25.13 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 92.7 t -115.2 117.39 55.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.307 178.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.39 -149.58 5.84 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.87 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.0 mt -114.63 150.03 35.73 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.852 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.494 HE22 ' CD2' ' A' ' 133' ' ' LEU . 2.4 tp-100 -137.4 139.34 40.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.775 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -68.63 -68.43 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.543 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -74.97 154.35 38.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.712 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . 0.528 HG21 HD21 ' A' ' 120' ' ' LEU . 81.4 p -106.3 3.96 28.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.013 0.435 . . . . 0.0 111.096 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 74.9 p -59.15 114.12 2.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.312 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.35 -164.39 18.94 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.656 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.8 mt-10 -116.27 -13.8 11.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.676 0.274 . . . . 0.0 111.306 -179.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.34 65.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.198 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 30.0 p -88.83 6.67 37.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.632 0.253 . . . . 0.0 111.674 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -110.4 133.53 53.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.153 0.501 . . . . 0.0 111.347 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.3 m95 -127.78 115.96 19.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.623 -179.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.4 p -78.12 123.33 26.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.049 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.435 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -85.89 136.93 21.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.99 0.424 . . . . 0.0 110.982 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -128.75 149.84 73.24 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.034 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.665 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 38.5 Cg_endo -66.71 137.79 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.449 2.1 . . . . 0.0 112.38 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 180' ' ' ASP . . . -75.61 -42.47 51.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -107.92 -169.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -91.64 -8.59 46.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.066 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -67.98 -38.31 82.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.047 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.665 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.6 mmp_? -88.59 150.84 22.85 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.824 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 60.4 m -133.28 167.83 19.67 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.881 0.372 . . . . 0.0 111.011 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.53 127.94 34.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.528 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.27 -14.72 63.28 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.086 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.53 155.98 40.01 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.031 0.443 . . . . 0.0 111.313 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 43.9 mttp -72.56 141.48 48.45 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.451 HG13 HD21 ' A' ' 181' ' ' LEU . 86.1 t -91.11 120.92 40.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -84.8 153.81 22.74 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-O 121.156 0.503 . . . . 0.0 111.381 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . 0.446 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.7 t -69.11 122.22 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.39 -14.77 35.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.399 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.33 127.13 31.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.947 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.9 m-20 -68.52 110.06 4.02 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.451 HD21 HG13 ' A' ' 175' ' ' VAL . 69.4 mt -96.36 149.23 21.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.79 0.805 . . . . 0.0 112.924 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.06 112.51 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.9 mp -92.96 135.64 33.97 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.14 -178.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.465 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.9 t -127.75 127.75 68.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.75 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -64.43 127.86 33.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -71.22 -31.82 45.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.698 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.0 t -80.08 -36.65 35.22 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 60.4 p -116.74 2.4 12.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 50.42 28.31 3.24 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 179.772 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 26.0 mtt180 -108.89 140.76 41.92 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.937 0.399 . . . . 0.0 110.99 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.3 m-85 -72.03 153.77 41.55 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.42 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 28.5 tp -75.31 76.72 2.41 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 105.253 -2.129 . . . . 0.0 105.253 175.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -76.82 149.66 36.18 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 115.454 1.649 . . . . 0.0 115.454 -174.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.1 tp -99.0 115.02 27.97 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 113.78 -1.554 . . . . 0.0 107.622 177.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.0 t -107.83 146.54 32.11 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -177.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -106.0 91.89 3.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.49 -175.07 47.05 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.36 -0.924 . . . . 0.0 111.507 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 79.6 m-20 -0.25 -78.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.379 0.671 . . . . 0.0 112.386 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 79.3 p -146.2 12.65 1.23 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.095 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 77.0 p -126.57 -178.54 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.868 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.617 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.6 m95 -107.81 136.3 47.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.223 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.532 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 21.4 m-70 -129.15 173.27 10.63 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.949 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.45 131.27 71.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.204 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -147.72 170.19 18.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.544 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.61 94.19 6.84 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.79 176.5 4.99 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.09 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.32 7.96 20.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.1 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -114.43 136.37 53.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.733 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.81 174.52 1.82 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.45 1.119 . . . . 0.0 113.119 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.8 m -168.61 119.86 0.78 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 112.886 -1.961 . . . . 0.0 107.72 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 48.7 mt -73.68 129.8 38.69 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.956 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -116.89 138.5 51.49 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.738 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.7 m -105.44 100.65 10.22 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.711 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.796 HG22 ' HG ' ' A' ' 22' ' ' LEU . 87.4 t -91.96 101.58 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.777 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.89 142.32 28.22 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.196 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.446 ' HD3' HG13 ' A' ' 177' ' ' VAL . 27.0 Cg_exo -62.76 104.97 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.18 1.92 . . . . 0.0 111.116 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.504 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.5 mm . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.24 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.3 mt -81.04 122.72 27.66 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -110.0 156.83 19.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.063 0.459 . . . . 0.0 111.093 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.5 p -68.2 155.33 39.88 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.753 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 71.97 -4.03 2.06 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.753 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.46 134.43 45.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.623 179.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -81.26 120.98 25.59 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.473 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.84 171.61 15.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -177.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.497 HG11 HD11 ' A' ' 62' ' ' LEU . 3.2 m -132.82 137.4 54.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.349 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -98.11 124.87 42.86 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.429 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 21.6 mt-30 -125.64 143.32 51.08 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.439 0.638 . . . . 0.0 112.339 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -128.89 144.08 51.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.851 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -86.61 120.58 28.08 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.134 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.19 121.25 44.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.258 -179.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 m -124.5 137.63 54.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.622 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.8 tt -177.64 146.16 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.581 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 47.8 m80 58.97 40.12 22.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.183 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 60.64 22.03 11.9 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.283 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -126.46 138.4 53.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.452 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -126.65 147.63 49.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.974 0.416 . . . . 0.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -159.39 172.84 17.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.564 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -120.47 140.42 51.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.45 178.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -128.97 143.57 50.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.424 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.9 p -106.96 138.33 43.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.014 0.435 . . . . 0.0 110.722 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.549 ' HA ' HD23 ' A' ' 49' ' ' LEU . 29.5 tp -60.08 111.04 1.36 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.091 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.39 165.68 11.76 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.599 -179.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.87 163.36 13.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.811 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -134.67 145.35 48.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.522 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.92 12.18 58.18 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.782 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -121.14 151.39 39.96 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.926 0.393 . . . . 0.0 110.808 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.9 -137.34 18.52 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.467 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -83.31 8.99 11.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.789 0.328 . . . . 0.0 110.893 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.28 31.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.099 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.467 ' H ' HD22 ' A' ' 44' ' ' ASN . 39.5 mt -78.52 135.06 37.24 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 110.509 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.3 m -75.66 150.52 37.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.56 0.695 . . . . 0.0 111.297 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -144.03 -167.13 2.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 108.594 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 37' ' ' LEU . 29.8 mt -131.87 142.82 49.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.7 mt-10 . . . . . 0 CA--C 1.503 -0.856 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.794 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 HG11 ' A' ' 21' ' ' VAL . 48.3 tp . . . . . 0 C--O 1.231 0.091 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.2 m -53.14 -48.74 67.68 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.455 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -68.27 -17.68 22.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 61.2 m -99.92 13.75 32.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -92.01 130.97 37.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.567 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.7 159.12 42.84 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.259 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.562 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -123.51 133.68 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.606 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.9 mt -81.72 64.77 6.57 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.511 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.5 mm-40 -44.13 -61.28 1.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -178.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.6 mm100 -125.21 165.4 18.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.706 0.765 . . . . 0.0 112.889 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -157.82 85.67 0.9 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.935 179.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -113.84 159.22 20.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.469 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.432 ' HB2' HH12 ' A' ' 76' ' ' ARG . 9.4 m -70.25 149.13 47.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 56.1 t -52.0 -45.05 40.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.004 0.43 . . . . 0.0 110.219 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.432 HH12 ' HB2' ' A' ' 74' ' ' SER . 1.9 tmm_? -57.37 -54.55 45.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.26 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.427 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -58.75 -44.96 90.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.909 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.6 tp -60.67 -47.17 87.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.444 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.868 0.365 . . . . 0.0 110.669 -179.864 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.824 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 2.2 mm-40 . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.791 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.824 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 56.2 mtpt -87.43 -51.85 5.7 Favored 'General case' 0 C--N 1.353 0.75 0 CA-C-N 120.324 1.42 . . . . 0.0 111.592 -3.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -66.31 -28.48 68.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.918 -1.492 . . . . 0.0 113.031 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.638 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.2 mptm? -60.29 -45.88 91.79 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.876 -0.729 . . . . 0.0 110.132 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . 0.659 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 22.6 t80 -74.14 -41.95 60.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.261 179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -56.83 -46.35 81.75 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.982 0.42 . . . . 0.0 110.557 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.1 tmm? -71.04 -41.98 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.736 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -57.47 -40.39 78.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.745 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 49.2 p -73.05 -52.71 13.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.273 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.71 -27.45 62.97 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.459 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.741 -179.921 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 121.144 0.497 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 98.0 m -79.56 146.74 32.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.16 131.92 35.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.826 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.28 141.98 47.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.041 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -62.32 126.07 26.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.093 0.473 . . . . 0.0 110.59 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.48 -11.34 50.61 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.053 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 141.26 31.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.06 126.97 32.61 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.2 pt -112.05 160.27 11.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.564 0.697 . . . . 0.0 112.777 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 153' ' ' THR . 20.3 tp -115.78 110.38 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.053 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.405 ' CD2' HD23 ' A' ' 69' ' ' LEU . 61.9 mt -98.4 116.51 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.641 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.562 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.1 ttp85 -102.81 116.38 32.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.62 179.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.7 t-80 -59.37 106.54 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 177.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.2 t -50.72 -45.65 58.64 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.454 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 37.5 t80 -65.27 -59.55 3.94 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.4 m -75.76 -16.42 60.13 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -3.35 48.49 Favored Glycine 0 N--CA 1.454 -0.159 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.379 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 61.9 mtm -84.76 -166.25 1.42 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.486 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.1 m-85 -131.67 140.53 49.36 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -177.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.416 HD13 HD21 ' A' ' 37' ' ' LEU . 27.8 tp -55.23 129.55 38.75 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.0 t -138.69 149.26 44.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.1 t -96.4 95.98 8.41 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 176.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.4 mt -71.85 154.53 41.2 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.412 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.2 m -83.96 3.58 33.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.048 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.1 p -90.8 127.19 36.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.717 0.294 . . . . 0.0 111.018 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.0 p . . . . . 0 C--N 1.327 -0.406 0 CA-C-O 120.846 0.355 . . . . 0.0 110.75 179.799 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.154 0.502 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.528 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 12.4 m-85 -98.12 167.2 11.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.264 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -87.05 145.51 26.44 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.041 0.448 . . . . 0.0 109.96 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 89.7 t -115.06 116.56 52.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.51 -151.62 6.25 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.705 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.5 mt -112.67 148.55 34.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.949 0.404 . . . . 0.0 110.737 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.19 40.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.87 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.5 -77.87 0.06 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.674 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.05 153.06 44.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 120' ' ' LEU . 73.2 p -104.3 4.02 33.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.099 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.4 p -56.2 115.46 2.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.67 -162.29 16.53 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.636 -0.792 . . . . 0.0 111.741 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . 0.536 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.1 mt-10 -118.97 -9.96 9.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.707 0.289 . . . . 0.0 111.39 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.93 -31.13 68.39 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -91.18 8.1 37.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.583 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.6 133.09 54.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.458 . . . . 0.0 111.183 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' TRP . . . . . 0.469 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.8 m95 -128.57 117.41 21.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.779 -178.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 10.7 p -79.2 125.99 30.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.136 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . 0.508 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -87.69 136.41 23.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.928 0.394 . . . . 0.0 110.938 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -128.6 150.94 76.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.087 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.716 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.0 Cg_endo -67.84 140.92 52.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.488 2.125 . . . . 0.0 112.286 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.87 -46.22 54.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.809 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.457 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 58.9 m -112.92 -171.09 1.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.44 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' LYS . . . . . 0.483 ' HG3' ' NE2' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -88.51 8.27 28.9 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.235 -179.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.483 ' NE2' ' HG3' ' A' ' 167' ' ' LYS . 8.7 mm-40 -81.36 -37.8 27.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.059 0.457 . . . . 0.0 110.567 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.716 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 78.4 mmt-85 -91.82 150.46 21.06 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.402 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 44.9 t -128.46 166.53 18.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.136 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 128.54 36.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.309 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 98.3 -16.39 60.03 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.877 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -69.1 156.38 38.77 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.929 0.395 . . . . 0.0 111.201 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -72.95 143.48 47.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 162' ' ' ILE . 93.0 t -93.43 118.89 40.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.458 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -83.39 155.34 23.54 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.322 0.582 . . . . 0.0 111.563 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 30.7 t -69.46 120.95 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 176.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -15.13 33.19 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.379 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -65.68 128.76 37.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.697 0.284 . . . . 0.0 110.732 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' ASP . . . . . 0.451 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 3.9 m-20 -69.76 111.17 5.34 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 175' ' ' VAL . 76.8 mt -97.27 148.73 22.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.65 112.02 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -91.89 138.24 31.71 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.141 0.496 . . . . 0.0 112.108 -178.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' VAL . . . . . 0.495 HG22 ' CD1' ' A' ' 191' ' ' TYR . 88.9 t -129.15 128.21 66.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.797 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -65.48 127.36 31.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 87.8 t -71.93 -33.35 47.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.637 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.7 p -80.42 -36.02 34.29 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 63.2 m -114.83 2.41 14.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 49.31 29.02 2.53 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 190' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.3 mtt180 -111.63 140.19 46.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 110.87 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 191' ' ' TYR . . . . . 0.495 ' CD1' HG22 ' A' ' 184' ' ' VAL . 52.0 m-85 -71.11 155.12 41.14 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.7 tp -75.52 75.83 2.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 193' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.4 t60 -75.46 150.09 38.33 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -174.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.5 tp -100.21 112.6 24.93 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 113.649 -1.614 . . . . 0.0 107.639 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 195' ' ' SER . . . . . 0.407 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 62.9 p -105.0 145.69 30.08 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.23 91.36 3.76 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 197' ' ' GLY . . . . . 0.572 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -78.69 -174.49 44.6 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.511 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 11.9 m-80 -0.42 -78.92 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.302 0.641 . . . . 0.0 112.366 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 50.4 m -146.93 13.19 1.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.927 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.8 p -126.61 -177.81 4.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.917 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 201' ' ' TRP . . . . . 0.643 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.6 m95 -108.56 135.09 50.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.314 0.578 . . . . 0.0 111.341 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 202' ' ' HIS . . . . . 0.572 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.4 m-70 -128.33 174.11 9.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.4 p -126.78 132.14 70.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 52.0 p-10 -150.09 167.11 27.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.715 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 205' ' ' ALA . . . . . 0.486 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.32 95.27 8.79 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.32 173.64 6.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.339 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -81.55 8.01 10.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 208' ' ' GLN . . . . . 0.473 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 74.9 mm-40 -114.67 137.42 51.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.731 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 209' ' ' GLN . . . . . 0.403 HE21 ' HB2' ' A' ' 209' ' ' GLN . 20.1 mt-30 -66.13 174.82 2.36 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 122.279 1.038 . . . . 0.0 112.809 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.0 m -168.01 121.02 0.89 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.186 -1.824 . . . . 0.0 107.945 178.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 211' ' ' LEU . . . . . 0.451 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 68.4 mt -75.37 128.06 34.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.98 0.419 . . . . 0.0 109.967 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.64 145.77 42.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.9 m -114.01 102.36 10.11 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.206 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 214' ' ' VAL . . . . . 0.747 HG22 ' HG ' ' A' ' 22' ' ' LEU . 80.4 t -93.39 105.55 16.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.041 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 215' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -116.69 141.4 28.07 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.247 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.5 Cg_exo -64.31 104.73 0.53 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.194 1.929 . . . . 0.0 111.192 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 217' ' ' ILE . . . . . 0.473 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.986 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 23.7 mm-40 . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.81 0.338 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.429 ' HB3' HG23 ' A' ' 112' ' ' THR . 44.4 m-85 -119.19 153.14 35.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.913 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.79 126.09 30.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.435 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 10.5 mmm180 -112.83 156.59 22.63 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.096 0.475 . . . . 0.0 111.226 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.3 p -67.46 156.09 37.44 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.801 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 70.92 -2.84 2.18 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.856 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.435 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.1 m-20 -73.25 133.82 44.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.6 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -80.8 120.49 24.74 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -136.42 171.98 16.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.568 HG11 HD11 ' A' ' 62' ' ' LEU . 3.3 m -133.09 135.79 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-N 114.682 -1.145 . . . . 0.0 108.239 176.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -96.85 123.65 40.61 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.563 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.537 ' NE2' HG21 ' A' ' 52' ' ' THR . 69.9 mt-30 -120.42 163.05 18.48 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 121.4 0.619 . . . . 0.0 111.359 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -150.96 139.43 20.48 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.422 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -83.81 121.41 27.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.513 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.612 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.67 119.09 35.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.968 -179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.4 m -122.91 136.9 55.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.002 0.43 . . . . 0.0 111.695 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.6 tt -171.49 145.32 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.513 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.3 m80 59.29 37.84 23.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.42 22.52 13.29 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.503 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.62 131.93 49.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.405 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -118.81 144.42 46.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.025 0.44 . . . . 0.0 111.41 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -154.03 171.93 18.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.631 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -119.41 141.14 49.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.429 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.7 mt -130.23 141.97 50.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.469 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.8 p -106.38 138.19 43.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.022 0.439 . . . . 0.0 110.531 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.6 tp -60.02 110.46 1.2 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.187 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.454 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.83 165.15 11.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.518 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.92 167.14 9.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.801 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.02 150.62 44.64 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.537 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.11 -2.64 89.34 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.967 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -108.84 156.07 20.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.947 0.403 . . . . 0.0 111.025 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.09 -141.6 23.41 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.276 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.503 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -81.07 7.88 9.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.753 0.311 . . . . 0.0 110.623 179.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.11 30.04 0.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.847 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 44' ' ' ASN . 41.8 mt -78.26 139.58 38.89 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.007 0.432 . . . . 0.0 110.415 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.5 m -80.15 150.5 30.17 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.545 0.688 . . . . 0.0 111.208 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -145.04 -168.6 2.98 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.658 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.499 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.8 mt -128.64 143.86 51.04 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.445 0.64 . . . . 0.0 112.031 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -110.63 139.08 46.22 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.809 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.514 ' HA ' HD23 ' A' ' 35' ' ' LEU . 47.3 t -77.57 140.13 39.65 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 176.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.537 HG21 ' NE2' ' A' ' 23' ' ' GLN . 72.1 p -109.54 172.75 6.67 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.178 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.743 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 47.0 t 18.1 59.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.579 -1.191 . . . . 0.0 112.814 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -102.08 -25.25 13.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.365 0.602 . . . . 0.0 109.614 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.528 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 69.4 p -164.69 67.95 0.15 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.109 -0.951 . . . . 0.0 110.225 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.528 ' HA ' ' N ' ' A' ' 55' ' ' SER . 24.1 pttm -149.1 39.98 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 122.692 0.397 . . . . 0.0 111.501 0.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.443 ' N ' ' HA ' ' A' ' 53' ' ' SER . 59.9 t30 -172.1 123.37 0.5 Allowed 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.759 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 60.88 166.01 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.51 178.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.759 ' HD2' HG22 ' A' ' 58' ' ' VAL . 18.6 Cg_endo -62.76 138.93 72.01 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.167 1.911 . . . . 0.0 111.971 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.413 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.9 Cg_endo -54.26 -40.02 84.15 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.299 1.999 . . . . 0.0 111.128 179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.406 ' O ' HG12 ' A' ' 64' ' ' ILE . 10.7 t70 -122.2 87.61 2.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.715 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.568 HD11 HG11 ' A' ' 21' ' ' VAL . 52.1 tp -70.08 -25.82 63.7 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.134 -178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.5 t -55.67 -47.22 77.09 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.454 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.7 pt -68.78 -16.76 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 67.6 m -101.3 13.76 34.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.889 0.376 . . . . 0.0 110.826 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.5 m -91.56 130.18 37.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.717 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -136.78 159.94 40.34 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.097 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.593 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -124.09 132.03 71.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.654 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.5 mt -79.92 65.73 5.17 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.496 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.6 mm-40 -44.53 -64.53 0.67 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.469 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.1 mm-40 -122.81 165.35 16.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 112.963 -177.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.9 m -156.89 86.51 0.98 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.022 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.2 mt -114.22 158.23 21.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.472 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.8 t -70.24 148.19 48.86 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 177.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.407 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 55.6 t -51.33 -45.1 32.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.9 ttp85 -57.82 -52.77 64.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.093 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -61.7 -43.13 99.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.9 tp -61.47 -48.23 82.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.199 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 25.8 mt-30 -65.17 -34.33 78.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.915 0.388 . . . . 0.0 110.576 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.67 -44.14 87.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.772 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.9 mtt -60.8 -46.8 89.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.875 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.64 -33.75 76.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.002 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.44 -35.24 77.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.817 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.19 -18.13 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.444 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.5 p -90.8 1.9 56.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.523 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.462 HG12 ' HG3' ' A' ' 87' ' ' GLU . 23.3 t -80.06 -60.47 2.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.87 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.462 ' HG3' HG12 ' A' ' 86' ' ' VAL . 44.9 mt-10 -147.48 90.3 1.85 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.859 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -168.98 129.33 1.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.736 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.5 m -77.57 -28.38 51.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.846 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -87.83 172.69 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.722 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.52 32.88 4.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.847 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -97.25 116.44 29.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.717 0.294 . . . . 0.0 110.825 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.488 ' HB ' HG21 ' A' ' 104' ' ' THR . 26.7 m -76.45 -24.47 15.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.277 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -112.24 86.02 2.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.541 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 39.2 t -86.11 -27.02 6.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.742 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 9.9 tp10 -57.96 -41.38 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.124 0.786 . . . . 0.0 113.124 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.742 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.1 pttm -80.74 -26.06 37.62 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.525 1.53 . . . . 0.0 112.698 -0.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -52.16 -57.46 9.55 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.66 ' H ' ' HG2' ' A' ' 96' ' ' GLU . 1.7 tmtp? -57.08 -52.39 65.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.347 -178.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.432 ' HB2' ' H ' ' A' ' 96' ' ' GLU . 28.9 m-85 -58.9 -30.29 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.871 0.367 . . . . 0.0 110.599 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 28.3 ttt -71.31 -40.41 70.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.802 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 24.1 ttt -68.35 -35.75 78.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.464 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -69.66 -44.64 70.11 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.479 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.488 HG21 ' HB ' ' A' ' 93' ' ' VAL . 29.2 p -65.93 -38.44 88.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.186 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -68.72 -44.86 72.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.002 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -74.84 -23.21 58.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.734 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.39 -33.1 23.57 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.676 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.22 -98.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.576 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.658 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . 159.93 177.3 32.9 Favored Glycine 0 CA--C 1.523 0.539 0 CA-C-O 119.287 -0.729 . . . . 0.0 112.241 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.658 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 35.6 m-70 55.99 70.32 0.65 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.075 1.438 . . . . 0.0 112.146 0.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -149.18 143.85 26.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.123 0.487 . . . . 0.0 111.157 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.429 HG23 ' HB3' ' A' ' 13' ' ' PHE . 87.8 m -74.03 146.27 43.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.212 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.96 133.77 35.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.701 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.5 mt -117.01 141.83 47.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.243 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -61.89 129.7 42.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.067 0.46 . . . . 0.0 110.463 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -12.09 58.05 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.117 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.44 140.75 32.16 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.096 0.474 . . . . 0.0 111.513 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.28 126.79 32.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.142 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 160' ' ' TRP . 48.2 pt -111.97 159.54 11.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.471 0.653 . . . . 0.0 112.746 -178.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.469 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.2 tp -114.51 108.8 17.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.889 -1.051 . . . . 0.0 109.895 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.408 ' CD2' HD23 ' A' ' 69' ' ' LEU . 67.0 mt -97.01 116.72 29.71 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.703 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.593 ' NH2' HG21 ' A' ' 68' ' ' VAL . 48.8 ttp85 -102.87 116.49 32.66 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.665 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.2 t-80 -59.47 106.55 0.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 43.1 t -49.76 -47.38 50.97 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 57.5 t80 -64.26 -61.23 2.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.8 t -74.26 -16.83 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.43 -2.77 51.59 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.379 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.2 mtt -83.46 -165.55 1.13 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.469 0.176 . . . . 0.0 110.626 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.7 m-85 -133.7 138.86 46.07 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.8 tp -55.65 125.54 21.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.587 ' SG ' HD21 ' A' ' 133' ' ' LEU . 17.7 p -136.26 147.71 47.67 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.4 t -93.15 98.6 11.41 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.587 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.7 mt -75.53 146.65 40.35 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.374 -178.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -77.95 5.9 8.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.019 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.3 p -97.95 120.56 38.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 66.5 m -74.92 -60.23 2.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.918 0.389 . . . . 0.0 110.264 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.424 ' HB2' ' OD2' ' A' ' 146' ' ' ASP . 19.5 mmm180 54.54 31.49 15.01 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.332 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.0 m -136.36 -30.48 0.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.865 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.6 t -166.77 166.91 15.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.961 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 81.0 p -91.37 -3.9 56.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.098 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.58 -0.45 53.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm 57.04 33.34 23.19 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.565 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -74.19 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.831 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -113.11 151.51 30.73 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.504 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 11.6 m-85 -100.91 173.32 6.54 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.043 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.424 ' OD2' ' HB2' ' A' ' 137' ' ' ARG . 43.4 m-20 -92.51 145.13 24.69 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 93.3 t -114.33 116.1 51.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.174 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.54 -152.82 6.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.002 -1.094 . . . . 0.0 113.246 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 52.4 mt -113.22 143.44 44.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.823 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -129.37 141.13 51.14 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.831 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.85 -52.71 13.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.487 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.504 ' HB3' HG22 ' A' ' 154' ' ' THR . 7.5 m-20 -87.66 151.36 23.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.691 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 67.2 p -104.96 -6.34 20.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.823 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . 0.504 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.37 115.59 2.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.467 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.14 -159.22 19.73 Favored Glycine 0 N--CA 1.442 -0.959 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.654 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.507 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -120.53 -13.9 8.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.719 0.295 . . . . 0.0 111.416 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.83 -33.35 66.68 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.6 m -88.62 6.22 39.28 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -110.02 133.75 52.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.146 0.498 . . . . 0.0 111.418 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.485 ' O ' HG12 ' A' ' 119' ' ' ILE . 56.6 m95 -128.56 117.54 21.45 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.715 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.427 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 14.4 p -79.1 127.64 32.27 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.095 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -89.64 134.83 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.2 m80 -128.61 151.72 77.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.262 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.705 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.1 Cg_endo -67.85 140.73 51.62 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.5 2.134 . . . . 0.0 112.515 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.83 -44.19 42.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 52.1 m -109.29 -173.64 2.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.132 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.569 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -90.46 6.15 44.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.147 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.569 HE22 ' HE2' ' A' ' 167' ' ' LYS . 10.5 mm-40 -80.58 -36.53 32.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.488 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.705 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 65.5 mmt-85 -90.0 148.16 23.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.229 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.4 m -127.99 166.8 17.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 111.382 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -66.64 133.81 51.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.235 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.96 -16.91 58.38 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.087 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -67.49 157.3 34.6 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.016 0.436 . . . . 0.0 111.313 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -74.36 140.53 44.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.238 178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 88.0 t -90.23 119.84 38.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.371 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.433 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 25.7 mmt180 -83.61 154.85 23.53 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-O 121.283 0.564 . . . . 0.0 111.406 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 31.6 t -69.55 120.47 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.94 -7.81 35.95 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.376 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -71.45 129.33 38.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 110.853 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.555 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.2 m-20 -70.8 109.84 5.23 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.432 HD21 HG13 ' A' ' 175' ' ' VAL . 63.9 mt -97.14 149.67 21.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.759 0.79 . . . . 0.0 113.035 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 52.8 mt -114.46 112.94 42.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.421 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.83 136.7 33.01 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.161 -178.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.45 HG22 ' CD1' ' A' ' 191' ' ' TYR . 74.1 t -128.73 123.13 58.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.735 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 91.4 p -62.5 125.59 24.46 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 80.1 t -68.7 -32.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.166 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 89.5 p -77.52 -38.49 48.74 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 41.2 t -115.59 2.95 13.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.38 27.17 3.51 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 20.9 mtt180 -107.79 142.5 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.974 0.416 . . . . 0.0 110.927 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.1 m-85 -73.74 154.9 39.41 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.421 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.0 tp -76.42 76.56 3.16 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.413 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.0 t60 -76.81 149.41 36.22 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 115.644 1.72 . . . . 0.0 115.644 -174.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -98.7 119.58 37.68 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 113.81 -1.541 . . . . 0.0 107.639 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.8 p -113.79 144.37 43.1 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -103.81 92.23 4.33 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.521 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -81.82 -176.86 51.44 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.321 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.521 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.3 m-20 4.28 -80.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.406 0.682 . . . . 0.0 112.449 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 37.5 t -145.24 8.2 1.2 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.019 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 57.3 m -122.39 -177.84 3.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.984 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.612 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -108.01 138.14 44.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.169 0.509 . . . . 0.0 111.129 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.5 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 28.3 m-70 -129.79 173.05 11.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.216 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.58 133.38 67.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.23 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.7 171.22 17.5 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.71 94.94 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.03 173.29 6.57 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.005 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -82.41 10.56 6.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.413 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 21.6 mt-30 -116.43 137.64 52.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.523 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -67.12 174.91 2.84 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 122.297 1.046 . . . . 0.0 113.303 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.4 m -169.16 121.7 0.77 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 112.931 -1.94 . . . . 0.0 107.812 178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.555 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.4 mt -74.74 130.58 39.73 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.018 0.437 . . . . 0.0 109.838 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -118.52 133.08 56.15 Favored 'General case' 0 CA--C 1.505 -0.783 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.083 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 52.2 m -99.78 102.17 13.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.998 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 89.3 t -93.26 102.89 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.794 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.13 139.76 24.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.452 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.8 Cg_exo -63.8 105.82 0.58 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.134 1.889 . . . . 0.0 111.174 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.485 HG23 HD21 ' A' ' 62' ' ' LEU . 1.5 mm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.022 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.564 HE21 ' H ' ' A' ' 13' ' ' PHE . 20.3 tp60 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.788 0.328 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.564 ' H ' HE21 ' A' ' 12' ' ' GLN . 50.7 m-85 -120.18 157.6 28.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.448 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.6 mt -81.15 121.91 26.7 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.48 157.2 19.2 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.104 0.478 . . . . 0.0 111.17 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -67.89 156.03 38.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.586 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 16' ' ' THR . 14.3 m-20 70.99 -3.29 2.06 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.89 -179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.9 m-20 -73.58 133.23 43.48 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -79.69 119.18 22.27 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.481 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 21.3 m -135.02 174.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.655 HG11 HD11 ' A' ' 62' ' ' LEU . 3.7 m -134.0 140.94 45.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.367 176.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -102.64 116.64 32.99 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.789 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.522 HE22 ' HE2' ' A' ' 34' ' ' LYS . 17.9 mt-30 -119.15 138.42 52.94 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.453 0.644 . . . . 0.0 112.259 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.0 p -123.06 143.8 49.72 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.648 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.7 m -84.35 123.18 29.91 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.391 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.563 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.59 122.04 45.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.338 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.1 m -125.01 136.21 53.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.62 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.3 tt -172.75 144.5 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.366 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.0 m80 58.59 37.5 25.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.918 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.441 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.76 26.21 15.5 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.327 179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -128.18 132.61 48.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.33 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -122.77 145.17 48.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.076 0.465 . . . . 0.0 111.396 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -156.39 178.62 10.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.783 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.522 ' HE2' HE22 ' A' ' 23' ' ' GLN . 32.7 mtmm -124.14 137.41 54.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.513 178.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.94 132.15 50.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.808 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.8 p -94.11 145.83 24.4 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.418 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.2 tp -69.2 108.94 3.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.081 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -106.18 164.0 12.35 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.305 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.93 164.71 13.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.44 140.86 39.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.659 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.01 17.25 28.36 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.246 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -121.29 146.11 47.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.691 0.282 . . . . 0.0 110.469 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.12 -135.15 14.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.371 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.422 HD22 ' C ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -84.02 9.16 13.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.737 0.303 . . . . 0.0 110.996 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.06 33.63 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.222 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 25.4 mt -79.94 136.15 36.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.976 0.417 . . . . 0.0 110.652 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.9 m -76.9 151.28 35.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.539 0.685 . . . . 0.0 111.219 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -146.02 -170.74 3.55 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.736 -1.12 . . . . 0.0 108.538 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 26.3 mt -126.41 145.75 50.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.483 0.659 . . . . 0.0 112.06 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -114.69 138.87 50.18 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 114.724 -1.126 . . . . 0.0 110.549 -179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.432 ' HA ' HD23 ' A' ' 35' ' ' LEU . 45.4 t -75.89 140.59 42.25 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 68.3 p -109.89 175.56 5.39 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.145 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.704 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 46.1 t 18.19 60.3 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.936 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -107.23 -20.76 13.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.799 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.483 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 46.0 t -166.28 69.47 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.444 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.483 ' HA ' ' N ' ' A' ' 55' ' ' SER . 6.6 ptpp? -141.67 31.24 1.66 Allowed 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 122.963 0.505 . . . . 0.0 111.191 0.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.406 ' HA ' ' CB ' ' A' ' 53' ' ' SER . 21.7 p-10 -170.72 129.57 0.81 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.276 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.759 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 61.27 166.16 0.1 OUTLIER Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.271 178.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.759 ' HD2' HG22 ' A' ' 58' ' ' VAL . 17.9 Cg_endo -63.62 139.11 68.07 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.25 1.966 . . . . 0.0 112.166 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.402 ' HD2' ' O ' ' A' ' 51' ' ' SER . 11.1 Cg_endo -55.1 -39.2 92.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.334 2.022 . . . . 0.0 111.159 179.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -121.96 89.21 3.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.726 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.655 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp -71.56 -29.01 64.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.202 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.9 m -51.25 -44.43 61.73 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.497 HD12 ' HB1' ' A' ' 38' ' ' ALA . 28.8 pt -72.46 -20.83 19.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.4 m -98.94 13.18 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.75 0.31 . . . . 0.0 111.158 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -89.25 129.56 35.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.133 0.492 . . . . 0.0 111.896 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -136.58 162.19 33.8 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.907 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.594 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.9 132.35 70.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.698 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 16.6 mt -80.47 66.7 6.07 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.519 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.3 mm-40 -46.75 -61.91 1.63 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 58.5 mm-40 -122.58 163.05 20.68 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.793 0.806 . . . . 0.0 112.899 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.6 t -156.1 83.33 1.0 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.819 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.4 mt -113.17 153.75 27.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.557 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 38.1 t -67.8 147.12 53.0 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.449 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 52.6 t -48.79 -44.64 15.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.106 0.479 . . . . 0.0 110.352 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.6 ttp85 -57.54 -53.7 55.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.225 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.63 -43.37 97.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.787 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.48 -46.68 89.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.349 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 49.8 mt-30 -66.23 -34.83 78.91 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.807 0.337 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.9 mtt -63.81 -44.24 93.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.695 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 86' ' ' VAL . 81.4 mt -69.41 -35.03 75.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.81 -35.52 78.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.156 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.6 -24.37 64.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.675 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 71.6 p -84.22 -5.72 59.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.703 0.287 . . . . 0.0 111.523 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 82' ' ' LEU . 45.3 t -87.69 -53.33 10.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.279 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.57 -88.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.159 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -148.66 -63.34 0.24 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.894 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.3 t 61.07 176.32 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.212 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.439 ' CD ' ' H ' ' A' ' 90' ' ' GLU . 0.0 OUTLIER -106.12 -9.37 16.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.912 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.66 31.66 81.53 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.752 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 62.49 -82.75 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.441 0.162 . . . . 0.0 111.346 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.4 t 64.0 119.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.933 0.397 . . . . 0.0 111.365 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -79.61 78.24 6.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.045 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.435 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 10.9 p -83.55 -1.3 5.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.455 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.8 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 4.8 mm-40 -53.58 -40.69 65.85 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.8 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 34.2 mtmm -87.17 -51.14 6.16 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 125.059 1.344 . . . . 0.0 111.652 -2.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -58.99 -33.89 71.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.141 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.696 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 32.3 mtmm -62.86 -36.56 83.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.358 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.775 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 37.1 t80 -74.15 -48.0 32.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.885 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.7 ttt -58.31 -37.29 74.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.608 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 45.7 ttm -73.0 -43.86 61.67 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.827 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.28 -44.14 88.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.915 0.388 . . . . 0.0 110.744 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.2 p -71.29 -40.56 70.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -55.42 33.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.371 . . . . 0.0 110.938 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.607 ' HA ' HE21 ' A' ' 106' ' ' GLN . 0.0 OUTLIER -62.94 -47.15 84.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.89 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.75 -27.12 70.62 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.609 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -71.66 104.91 1.54 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.564 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.708 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . -77.24 177.85 52.11 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.411 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.708 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 77.2 m-70 55.1 32.37 18.17 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.953 1.377 . . . . 0.0 112.29 0.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -107.54 148.13 29.65 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.072 0.463 . . . . 0.0 111.477 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.0 m -78.71 148.2 33.16 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.124 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.19 132.47 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.672 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.2 mt -116.89 143.78 45.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.215 179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -63.88 133.74 53.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.09 0.472 . . . . 0.0 110.469 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.89 -12.44 64.14 Favored Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.996 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.98 139.9 33.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.069 0.462 . . . . 0.0 111.509 -179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -82.13 126.51 32.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.7 pt -111.45 160.93 10.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.536 0.684 . . . . 0.0 112.773 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.432 HD21 HG21 ' A' ' 153' ' ' THR . 20.1 tp -116.97 108.97 16.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.866 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.411 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -96.44 117.72 31.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.613 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.594 ' NH2' HG21 ' A' ' 68' ' ' VAL . 46.8 ttp85 -103.25 116.77 33.09 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.758 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.1 t-80 -59.98 106.48 0.51 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 177.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 40.3 t -50.76 -44.99 58.68 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.491 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 49.2 t80 -64.85 -60.58 2.91 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.477 ' OG ' HD13 ' A' ' 149' ' ' LEU . 58.3 p -77.1 -14.53 59.79 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.26 -0.29 48.67 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.233 -179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -83.78 -165.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -134.42 140.33 46.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 25.9 tp -55.12 125.91 22.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.2 t -135.2 149.39 49.9 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.1 t -95.91 97.79 9.91 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.6 mt -74.18 151.26 40.04 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.681 -178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 76.2 p -80.79 6.06 14.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.866 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 77.5 p -93.66 123.03 36.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.0 110.986 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t -65.9 -60.43 2.87 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.806 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -172.09 -78.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.876 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.1 m -158.85 -30.2 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.972 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.9 m -87.78 179.9 6.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.044 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 75.5 p -73.42 -18.97 61.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.94 146.83 53.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.734 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -112.78 -89.45 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.33 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 55.32 -89.46 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.005 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.03 148.0 23.44 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.296 0.57 . . . . 0.0 111.633 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.8 m-85 -99.41 169.82 9.06 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.218 178.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -89.23 140.74 29.18 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.712 178.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.0 t -110.39 117.66 55.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.57 -147.81 5.76 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.73 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 77.2 mt -117.93 148.6 42.02 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.935 0.397 . . . . 0.0 110.549 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -141.67 139.38 32.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.803 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.1 -72.91 0.16 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.556 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.16 149.29 45.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.432 HG21 HD21 ' A' ' 120' ' ' LEU . 73.9 p -109.98 -2.8 16.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.205 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.2 p -54.84 116.81 2.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.69 -159.36 18.32 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.591 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.545 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.4 mt-10 -120.42 -10.06 9.35 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.809 0.338 . . . . 0.0 111.141 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.03 -31.95 67.5 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.8 m -93.93 9.52 37.1 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -110.49 131.48 55.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.094 0.473 . . . . 0.0 111.409 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.472 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.7 m95 -126.7 116.43 20.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.579 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 9.6 p -78.93 127.39 31.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.24 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.518 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.72 135.21 26.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.961 0.41 . . . . 0.0 110.986 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.405 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.0 m80 -128.22 150.17 73.28 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.158 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.6 Cg_endo -67.36 139.85 51.01 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.668 2.245 . . . . 0.0 112.153 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.25 -44.93 58.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.697 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.461 ' HB3' HE21 ' A' ' 168' ' ' GLN . 51.0 m -110.98 -171.83 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.249 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.539 ' HE2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -91.88 11.26 25.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.227 -179.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.539 HE22 ' HE2' ' A' ' 167' ' ' LYS . 7.3 mm-40 -84.74 -34.59 22.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.112 0.482 . . . . 0.0 110.437 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.708 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.5 mmp_? -92.57 147.21 23.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.14 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 31.3 t -126.52 166.46 17.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.826 0.346 . . . . 0.0 111.298 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.5 OUTLIER -65.56 131.66 46.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.463 179.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.87 -14.13 65.9 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.146 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.6 mt-10 -70.51 154.86 41.43 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.033 0.444 . . . . 0.0 111.134 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -70.75 143.75 51.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.518 HG21 HD12 ' A' ' 162' ' ' ILE . 98.2 t -94.02 110.86 24.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.432 179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -73.71 153.04 40.23 Favored 'General case' 0 CA--C 1.5 -0.974 0 CA-C-O 121.308 0.575 . . . . 0.0 111.409 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 38.7 t -68.69 121.4 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 176.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.4 -15.26 32.69 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.55 -0.834 . . . . 0.0 112.172 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -65.05 127.58 32.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 120.833 0.349 . . . . 0.0 110.9 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -68.92 112.25 5.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.484 HD21 HG13 ' A' ' 175' ' ' VAL . 65.3 mt -98.77 149.02 23.3 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.836 0.827 . . . . 0.0 113.166 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.473 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.8 mt -114.57 112.97 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.419 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.7 mp -92.97 138.98 31.0 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.1 0.476 . . . . 0.0 111.988 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.468 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.9 t -130.77 123.27 54.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.896 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.0 t -63.04 122.09 15.2 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.545 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 79.2 t -65.44 -34.46 70.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 120.806 0.336 . . . . 0.0 111.253 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.9 p -78.03 -39.65 41.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.495 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 49.2 m -113.22 9.63 18.44 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.506 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.56 30.7 0.37 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.718 0.636 . . . . 0.0 112.587 179.257 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.506 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 32.5 mtt85 -111.79 141.4 45.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.939 -179.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 61.3 m-85 -73.0 153.41 40.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.8 tp -75.61 75.65 2.62 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 175.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.407 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 80.8 t60 -75.2 151.63 38.45 Favored 'General case' 0 C--N 1.295 -1.771 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -174.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.9 tp -101.43 119.44 38.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.559 176.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 35.5 p -113.51 146.73 39.17 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.09 89.61 3.12 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.23 -174.75 43.88 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.214 -0.994 . . . . 0.0 111.515 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.6 m-80 1.11 -78.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.421 0.688 . . . . 0.0 112.417 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 48.9 m -147.09 10.96 1.03 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.099 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.6 p -125.37 -178.85 4.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.941 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.563 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.0 m95 -107.49 135.3 49.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.273 0.559 . . . . 0.0 111.175 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.478 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 25.0 m-70 -126.95 172.72 10.21 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.23 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.32 132.8 70.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.121 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.74 170.52 19.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.549 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.38 96.34 8.3 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.38 -179.46 3.64 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.403 -177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.6 8.36 28.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.283 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.407 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 82.2 mt-30 -117.21 137.28 52.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.569 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.473 ' NE2' HD13 ' A' ' 182' ' ' ILE . 94.4 mt-30 -64.63 174.51 1.75 Allowed 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 122.295 1.045 . . . . 0.0 112.949 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.3 m -166.58 121.16 1.11 Allowed 'General case' 0 N--CA 1.44 -0.975 0 CA-C-N 113.13 -1.85 . . . . 0.0 107.994 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.3 mt -74.99 128.94 36.76 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.055 0.455 . . . . 0.0 109.89 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.9 m95 -116.53 147.83 41.42 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.456 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 53.1 m -114.86 99.77 7.73 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.462 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.741 HG22 ' HG ' ' A' ' 22' ' ' LEU . 74.0 t -92.09 101.12 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.842 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.415 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -115.58 142.31 28.68 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.056 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.427 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.42 104.32 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.2 1.933 . . . . 0.0 110.995 179.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.481 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.211 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.626 HE21 ' H ' ' A' ' 13' ' ' PHE . 24.7 tp60 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.749 0.309 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.626 ' H ' HE21 ' A' ' 12' ' ' GLN . 48.0 m-85 -119.35 153.64 34.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.25 123.35 27.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 10.5 mmm180 -111.56 156.38 21.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.162 0.505 . . . . 0.0 111.396 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.428 ' OG1' ' HB3' ' A' ' 110' ' ' HIS . 7.6 p -67.35 156.62 36.01 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.611 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 16' ' ' THR . 8.5 m-20 71.39 -5.05 1.68 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.8 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.2 m-20 -72.68 133.84 44.8 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.684 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -80.64 121.74 26.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.512 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.24 172.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -177.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.572 HG11 HD11 ' A' ' 62' ' ' LEU . 3.5 m -133.32 136.28 55.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 114.545 -1.207 . . . . 0.0 108.222 176.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.74 121.96 40.27 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.557 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.458 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 23.2 mt-30 -118.96 161.31 20.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.375 0.607 . . . . 0.0 111.425 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.94 140.82 24.79 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.497 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 27.3 m -84.21 120.34 26.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.419 179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.61 120.79 42.14 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.01 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.9 m -125.4 129.66 50.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.599 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.51 HG23 ' CD2' ' A' ' 29' ' ' HIS . 15.7 tt -165.21 146.28 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.624 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.51 ' CD2' HG23 ' A' ' 28' ' ' ILE . 43.6 m-70 58.47 44.44 18.03 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.225 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.447 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 60.27 22.23 11.66 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.854 179.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -127.62 147.5 50.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.482 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -132.75 148.5 52.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.957 0.408 . . . . 0.0 111.179 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -159.47 173.11 16.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.597 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.2 mtmm -120.66 137.06 54.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.447 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.493 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.9 mt -126.24 141.72 51.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.9 p -104.73 141.83 35.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.022 0.439 . . . . 0.0 110.387 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.3 tp -64.31 109.26 1.84 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.121 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.468 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -107.11 162.69 13.64 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.545 -179.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.48 164.52 14.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.65 143.21 35.02 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.679 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.84 12.36 42.53 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.267 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -116.72 150.15 38.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.662 0.268 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.88 -138.34 19.27 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.317 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.6 p30 -84.69 11.93 8.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.661 0.267 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.96 29.55 0.33 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.269 179.537 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.8 mt -78.65 140.85 38.34 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 120.975 0.417 . . . . 0.0 110.626 179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.46 152.56 26.05 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.557 0.694 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -146.49 -169.19 3.21 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.581 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.5 mt -128.06 143.8 51.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.423 0.63 . . . . 0.0 111.964 -178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -111.98 140.87 46.29 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.651 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.493 ' HA ' HD23 ' A' ' 35' ' ' LEU . 86.0 p -78.54 141.71 37.92 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 69.1 p -109.36 173.59 6.25 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.413 -0.515 . . . . 0.0 111.219 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.679 ' HB3' ' H ' ' A' ' 58' ' ' VAL . 83.1 p 18.3 59.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.58 -1.191 . . . . 0.0 112.706 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -103.38 -39.29 6.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.766 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.523 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 35.7 t -168.74 66.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.523 ' HA ' ' N ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -156.4 155.94 33.0 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.025 0.53 . . . . 0.0 110.979 0.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' N ' ' HA ' ' A' ' 53' ' ' SER . 6.6 t30 65.98 118.45 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.013 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.768 HG22 ' HD2' ' A' ' 59' ' ' PRO . 0.6 OUTLIER 61.2 165.62 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.643 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.768 ' HD2' HG22 ' A' ' 58' ' ' VAL . 18.1 Cg_endo -64.1 138.05 60.05 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.326 2.017 . . . . 0.0 112.044 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.445 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.2 Cg_endo -52.84 -37.86 77.56 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.29 1.993 . . . . 0.0 111.399 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.433 ' O ' HG12 ' A' ' 64' ' ' ILE . 12.8 t70 -124.35 89.06 3.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.658 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.572 HD11 HG11 ' A' ' 21' ' ' VAL . 42.9 tp -72.32 -27.92 62.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.469 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.9 p -53.64 -42.71 68.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.468 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.3 pt -72.18 -17.72 19.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 63.5 m -101.92 14.27 32.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.651 0.262 . . . . 0.0 111.226 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.1 m -90.67 128.94 36.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.079 0.466 . . . . 0.0 111.719 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -136.35 159.38 41.93 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.984 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.561 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.2 t -123.23 132.56 71.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.716 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.06 65.87 5.36 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.2 mm-40 -45.24 -67.09 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.476 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 18.6 mm-40 -118.99 164.48 15.41 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.687 0.756 . . . . 0.0 112.82 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.1 t -157.21 82.59 0.92 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.864 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.7 mt -109.62 157.37 19.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.419 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.0 t -69.68 146.82 51.29 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.422 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.6 t -49.38 -46.06 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 16.8 ttp-105 -55.24 -58.53 7.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.097 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -55.05 -46.54 75.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.923 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.3 tp -58.78 -49.32 78.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.243 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 94.7 mt-30 -64.18 -33.21 75.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.754 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -66.99 -42.25 85.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.765 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.8 mtt -63.03 -43.73 97.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.905 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.7 mt -69.71 -35.24 74.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.82 -31.67 71.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.187 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -71.3 -27.37 63.36 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.496 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 60.3 p -78.1 -10.09 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.77 0.319 . . . . 0.0 111.387 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.8 t -76.79 -21.32 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.663 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -129.77 -166.87 1.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.501 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -57.74 118.76 5.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.822 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 79.3 p -141.02 147.97 39.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.984 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -168.47 115.48 0.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.76 36.99 0.74 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.603 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -78.06 -34.9 50.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.776 0.322 . . . . 0.0 110.971 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 24.0 m -79.24 -170.6 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.357 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 100' ' ' PHE . 3.9 p-10 -62.32 92.37 0.04 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.42 1.66 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.887 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.781 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.0 mm-40 -53.49 -41.52 66.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 118.744 -0.646 . . . . 0.0 112.34 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.1 mttt -88.41 -51.37 5.77 Favored 'General case' 0 C--N 1.351 0.654 0 C-N-CA 125.005 1.322 . . . . 0.0 111.225 -3.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -63.2 -28.36 69.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.724 -178.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 23.9 tptm -63.31 -40.76 98.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.119 -0.633 . . . . 0.0 109.912 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.644 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.4 t80 -74.26 -44.12 54.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.949 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.58 -41.28 76.68 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.391 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.4 tpt -74.97 -41.15 60.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.992 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.464 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.0 ttmp? -57.82 -42.82 85.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.942 0.401 . . . . 0.0 110.552 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 77.0 m -72.06 -48.56 43.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.747 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.1 64.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.8 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.02 -55.25 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.196 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.65 7.13 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.451 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 54.92 20.31 18.83 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.533 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.538 ' N ' ' HA ' ' A' ' 110' ' ' HIS . . . -55.5 -65.94 3.19 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.844 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.538 ' HA ' ' N ' ' A' ' 109' ' ' GLY . 29.7 t-80 -93.08 -40.41 10.53 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 117.695 0.747 . . . . 0.0 111.315 0.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -157.28 146.98 20.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.077 0.465 . . . . 0.0 111.502 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.468 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 85.6 m -76.25 147.18 38.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.906 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -81.33 131.12 35.27 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.756 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.0 mt -115.26 140.9 48.71 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.22 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -61.45 130.04 44.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.008 0.432 . . . . 0.0 110.341 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.35 -13.06 58.54 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.13 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.51 141.28 32.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.042 0.449 . . . . 0.0 111.359 179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.67 128.29 34.2 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.097 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 41.5 pt -113.39 159.53 13.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.579 0.704 . . . . 0.0 112.818 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.476 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.5 tp -116.09 110.5 18.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.889 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 56.0 mt -97.98 118.01 33.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.469 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.561 ' NH2' HG21 ' A' ' 68' ' ' VAL . 54.4 ttp85 -103.0 116.39 32.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.73 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.529 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.3 t-80 -59.29 105.67 0.36 Allowed 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 177.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 46.9 t -50.28 -45.56 54.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.529 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.5 t80 -64.2 -61.85 1.99 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.427 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -76.62 -13.75 60.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 72.82 1.34 54.49 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.172 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 53.9 mtt -84.04 -164.98 1.02 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.473 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 68.9 m-85 -135.42 138.67 43.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.4 tp -54.75 126.2 23.11 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 42.1 t -134.69 148.27 50.28 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.6 t -95.21 96.57 9.28 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.525 -1.216 . . . . 0.0 107.758 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.5 mt -73.96 152.03 40.2 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 89.9 p -83.66 6.41 20.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.083 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.3 p -95.4 121.6 37.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.724 0.297 . . . . 0.0 111.025 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.407 ' H ' ' HA ' ' A' ' 140' ' ' THR . 47.4 t -62.82 -57.06 12.19 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.772 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -166.24 -33.55 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.643 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.4 t -157.23 111.28 2.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.935 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.5 t 58.13 23.13 9.82 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.011 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.407 ' HA ' ' H ' ' A' ' 136' ' ' SER . 73.8 m 65.85 136.56 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.309 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -137.84 -86.58 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.868 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.608 ' HG2' ' H ' ' A' ' 143' ' ' LEU . 35.5 tttm -178.23 -170.3 0.22 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.751 0.31 . . . . 0.0 110.814 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.608 ' H ' ' HG2' ' A' ' 142' ' ' LYS . 4.3 mm? 60.09 -108.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.804 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.96 145.74 25.87 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.401 0.62 . . . . 0.0 112.321 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.53 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.2 m-85 -101.73 170.54 8.1 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.887 -1.051 . . . . 0.0 108.98 178.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.35 142.47 27.7 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 67.7 t -112.71 117.22 54.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.344 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.06 -146.89 5.54 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.844 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 73.1 mt -117.92 152.61 35.1 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.838 0.352 . . . . 0.0 110.531 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -142.32 140.1 32.04 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.66 -46.37 46.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.463 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -87.17 143.3 27.36 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.724 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 72.2 p -105.83 -8.54 17.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.702 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -53.23 114.44 1.47 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.513 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.91 -155.39 20.19 Favored Glycine 0 N--CA 1.441 -1.028 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.614 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -123.04 -13.94 7.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.704 0.288 . . . . 0.0 111.362 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.53 -32.99 67.62 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 74.3 m -90.47 8.14 35.33 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -111.55 132.26 54.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.055 0.455 . . . . 0.0 111.486 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.9 m95 -126.75 118.41 24.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.661 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -80.08 126.59 31.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.98 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.444 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -88.19 135.8 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -128.77 150.72 75.72 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.253 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.679 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.16 138.87 53.33 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.585 2.19 . . . . 0.0 112.349 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.19 -40.29 45.79 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.557 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 96.0 p -109.05 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.6 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.76 5.05 53.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.655 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 19.6 mp0 -85.48 -29.56 24.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.041 0.448 . . . . 0.0 110.866 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.679 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 73.9 mmt-85 -92.11 146.71 23.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.374 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 45.1 t -129.52 167.55 17.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.322 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.24 136.19 56.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.376 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.48 -15.91 55.15 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.459 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 170' ' ' SER . 30.8 mt-10 -68.36 155.48 39.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.026 0.441 . . . . 0.0 111.254 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -73.38 141.47 47.0 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.43 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 162' ' ' ILE . 98.1 t -91.07 123.1 43.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.375 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.4 HH11 ' N ' ' A' ' 12' ' ' GLN . 28.9 mmt180 -87.69 154.67 20.4 Favored 'General case' 0 CA--C 1.496 -1.126 0 CA-C-O 121.266 0.555 . . . . 0.0 111.405 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 34.9 t -70.76 120.95 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.62 -11.63 30.3 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.907 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -72.21 126.73 30.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.75 0.309 . . . . 0.0 110.779 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.562 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.4 m-20 -69.49 115.5 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 73.9 mt -100.31 148.26 24.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.763 0.792 . . . . 0.0 112.961 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.445 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.6 mt -113.49 112.75 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 176.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.4 mp -93.16 139.45 30.58 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.073 -178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 191' ' ' TYR . 71.4 t -130.8 127.8 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.718 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 4.3 m -65.05 124.95 23.44 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.489 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 94.2 t -69.1 -32.07 52.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.716 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.88 -36.2 36.9 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 61.3 m -116.64 4.9 13.17 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -177.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.15 31.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.467 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 30.0 mtt85 -112.25 141.69 45.65 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.2 m-85 -72.88 152.92 41.24 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.418 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 30.5 tp -75.11 76.75 2.28 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.442 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -76.88 150.12 36.04 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -174.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.1 tp -99.87 119.09 37.66 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.627 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 55.6 p -113.48 147.7 37.36 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -107.0 90.8 3.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.528 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -174.49 45.7 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.411 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' A' ' 197' ' ' GLY . 18.0 m120 0.6 -78.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.397 0.679 . . . . 0.0 112.449 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 57.4 m -147.68 12.85 1.03 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.126 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 54.6 m -126.9 -178.14 4.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.56 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.9 m95 -107.88 134.44 50.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.175 0.512 . . . . 0.0 111.158 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.494 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 27.6 m-70 -126.46 172.46 10.17 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.1 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.1 p -126.93 131.59 70.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.237 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -148.73 172.09 15.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.655 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.25 95.54 7.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.022 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.9 -179.03 3.52 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.299 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -88.61 7.94 30.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.17 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.442 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.17 138.33 51.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.584 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.445 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.4 mt-30 -68.37 173.41 4.9 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 122.274 1.035 . . . . 0.0 112.828 -178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -164.79 120.4 1.43 Allowed 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 113.121 -1.854 . . . . 0.0 107.843 178.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.562 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.5 mt -73.89 127.52 33.06 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 120.47 -0.492 . . . . 0.0 109.943 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.418 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 98.3 m95 -114.76 140.92 48.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.731 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.2 t -107.9 100.45 9.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.55 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 65.0 t -92.16 102.93 14.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.781 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.27 142.09 28.13 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.349 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.426 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.2 Cg_exo -63.54 103.99 0.42 Allowed 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.218 1.946 . . . . 0.0 111.165 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.512 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.0 mm . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.351 -0.833 . . . . 0.0 111.295 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 120.728 0.299 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.452 ' HB3' HG23 ' A' ' 112' ' ' THR . 68.6 m-85 -116.67 154.58 30.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.332 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.1 mt -76.91 120.61 22.28 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.7 mmm180 -109.87 156.19 20.71 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.066 0.46 . . . . 0.0 111.217 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.0 p -67.1 157.68 33.01 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 70.53 -4.71 1.57 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.426 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.6 m-20 -72.28 133.01 44.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.75 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -79.53 119.84 23.07 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.54 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.1 m -137.06 172.41 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.68 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 5.4 m -132.71 137.55 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.368 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.773 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -97.8 120.66 38.59 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.854 -0.339 . . . . 0.0 110.535 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 212' ' ' TRP . 39.2 mt-30 -119.0 159.68 23.41 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-O 121.416 0.627 . . . . 0.0 111.521 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.9 p -146.24 140.76 26.78 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.563 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.0 m -83.35 124.09 30.29 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.405 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.18 118.5 32.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.914 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.9 m -122.4 136.56 54.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.736 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 tt -176.0 143.84 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.781 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.3 m80 58.03 42.51 22.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.391 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt 60.03 22.02 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.426 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -127.19 129.67 48.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.704 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -121.72 144.45 48.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.022 0.439 . . . . 0.0 111.18 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -155.37 175.58 13.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.806 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 23.9 mtmm -122.36 136.63 54.93 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.561 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -126.51 141.28 51.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.64 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.593 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.7 t -105.08 144.8 31.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.976 0.417 . . . . 0.0 110.633 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 130' ' ' LEU . 34.7 tp -64.01 115.34 4.82 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.817 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.432 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.0 163.83 14.62 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.56 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.04 166.83 10.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.753 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.3 144.46 32.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.439 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.63 14.94 38.76 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.288 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -117.64 146.76 43.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.8 0.333 . . . . 0.0 110.693 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -135.24 14.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.538 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -84.3 9.33 13.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.629 0.252 . . . . 0.0 110.906 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.59 30.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.177 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 42.9 mt -78.68 139.54 38.49 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.093 0.473 . . . . 0.0 110.712 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.5 m -80.67 152.62 28.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.228 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -146.96 -163.91 1.87 Allowed 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.728 -1.124 . . . . 0.0 108.436 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.47 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.28 140.71 49.84 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 112.203 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -107.89 137.92 45.04 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.673 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.471 ' HA ' HD23 ' A' ' 35' ' ' LEU . 49.3 m -78.31 142.62 37.62 Favored 'General case' 0 N--CA 1.44 -0.975 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.517 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 71.6 p -105.55 157.67 17.22 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.362 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.491 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 20.8 t -51.29 -17.69 0.78 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.323 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.1 m120 61.78 25.96 15.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.402 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.5 m -146.22 68.85 1.19 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.355 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -82.5 -19.45 38.71 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.043 0.537 . . . . 0.0 110.453 -0.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.517 ' C ' ' HB ' ' A' ' 52' ' ' THR . 0.8 OUTLIER -158.14 -103.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.213 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.4 t 60.79 100.49 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.43 ' HG3' HG22 ' A' ' 52' ' ' THR . 6.7 Cg_exo -75.12 139.34 23.87 Favored 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 123.17 2.58 . . . . 0.0 111.211 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.41 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.1 Cg_endo -50.43 -36.95 50.21 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.364 2.042 . . . . 0.0 111.641 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -122.52 82.78 2.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.682 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 21' ' ' VAL . 42.0 tp -64.62 -30.76 71.79 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.1 p -48.83 -52.65 23.02 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.432 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 31.0 pt -69.94 -15.14 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.68 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.95 -1.87 38.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.2 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.458 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.7 m -84.17 134.01 34.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 0.0 112.199 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -138.2 161.38 37.0 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.952 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.555 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.5 t -125.82 132.12 71.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.727 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.83 64.5 5.63 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.504 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.2 mm-40 -43.3 -62.83 0.94 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -178.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.434 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.6 mm-40 -124.74 164.33 20.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.744 0.783 . . . . 0.0 112.716 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.3 t -156.29 84.08 0.99 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.387 -1.279 . . . . 0.0 108.888 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.403 HD13 ' SD ' ' A' ' 81' ' ' MET . 3.8 mt -112.99 154.94 25.67 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.397 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 81.9 p -67.68 150.21 49.01 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.527 HG12 HE21 ' A' ' 79' ' ' GLN . 43.2 t -52.69 -41.94 39.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.055 0.455 . . . . 0.0 110.274 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.9 ttp85 -59.98 -51.44 69.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.13 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.31 -38.65 91.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.745 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.5 tp -64.18 -44.17 92.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.862 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.527 HE21 HG12 ' A' ' 75' ' ' VAL . 44.8 mt-30 -67.92 -35.42 78.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.964 0.411 . . . . 0.0 110.469 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.54 -42.33 92.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.704 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.448 ' O ' HG23 ' A' ' 85' ' ' THR . 66.7 mtt -64.7 -44.1 91.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.79 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.42 -35.21 80.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.098 0.475 . . . . 0.0 110.374 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -35.4 77.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.98 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -77.68 -17.66 57.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.556 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.448 HG23 ' O ' ' A' ' 81' ' ' MET . 42.1 p -89.19 5.58 44.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.877 0.37 . . . . 0.0 111.252 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.2 t -83.84 -31.38 8.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.333 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -87.97 -28.2 21.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.955 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -132.55 139.26 47.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.883 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 77.8 p -118.95 16.41 13.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.084 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -123.1 141.04 52.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.995 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.03 37.36 0.76 Allowed Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.782 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -98.78 -71.08 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.673 0.273 . . . . 0.0 111.261 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 17.4 m -57.5 151.9 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.623 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.54 81.51 8.82 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.539 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.456 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.9 p -81.29 0.71 3.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.688 -179.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.795 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.1 OUTLIER -53.96 -38.77 65.33 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.795 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 96.5 mttt -88.18 -52.02 5.46 Favored 'General case' 0 C--N 1.352 0.684 0 CA-C-N 120.431 1.469 . . . . 0.0 111.529 -3.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -65.85 -28.76 69.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.033 -1.44 . . . . 0.0 113.071 -177.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.522 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 75.7 mmtt -59.51 -48.96 79.62 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.139 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.643 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 74.3 t80 -73.96 -39.53 63.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.564 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 46.5 ttm -59.87 -38.09 81.2 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.573 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 ttt -75.17 -46.93 30.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.675 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -58.01 -43.83 86.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 62.9 m -72.07 -45.72 59.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.49 -56.56 18.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.288 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -70.66 -35.33 72.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.265 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -58.68 -66.04 3.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.695 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.68 -84.94 0.17 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.665 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.544 ' HA2' ' HB3' ' A' ' 110' ' ' HIS . . . 152.87 -179.73 29.08 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.488 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.544 ' HB3' ' HA2' ' A' ' 109' ' ' GLY . 4.1 t60 56.37 42.38 27.76 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.953 1.377 . . . . 0.0 111.697 -0.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -125.55 140.22 52.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.198 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.452 HG23 ' HB3' ' A' ' 13' ' ' PHE . 88.8 m -71.28 146.36 48.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.348 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.39 133.31 35.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.419 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.56 142.31 47.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.994 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -63.25 124.45 21.24 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.132 0.491 . . . . 0.0 110.484 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.94 -13.64 41.21 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.887 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.48 141.31 33.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.993 0.425 . . . . 0.0 111.328 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.25 128.45 34.2 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.3 pt -113.01 159.36 13.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.579 0.704 . . . . 0.0 112.833 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.434 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.42 109.29 17.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.834 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 mt -97.5 116.86 30.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.696 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.555 ' NH2' HG21 ' A' ' 68' ' ' VAL . 61.8 ttp85 -102.67 116.51 32.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.706 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 19.5 t-80 -59.88 106.78 0.53 Allowed 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 177.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.458 ' OG ' HG22 ' A' ' 66' ' ' THR . 41.5 m -52.06 -43.45 63.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -176.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.47 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 56.4 t80 -66.0 -58.67 5.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 20.0 m -79.12 -13.3 59.82 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . 0.447 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 72.18 -0.85 37.13 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.307 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.2 mtt -83.24 -165.47 1.1 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.479 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.5 m-85 -133.94 139.0 45.84 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 37' ' ' LEU . 23.5 tp -55.77 124.95 19.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.1 t -133.36 148.08 51.84 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -176.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -94.19 98.76 11.18 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.1 mt -76.91 147.34 37.06 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.578 -178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 53.0 m -78.89 6.22 9.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.911 -179.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.9 p -92.2 124.1 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.2 t -62.85 -60.6 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.879 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 33.1 tpt180 -176.76 -61.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.517 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.0 p -142.4 23.99 1.95 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.573 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.3 m 59.12 88.88 0.06 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.79 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 4.1 t -170.14 -24.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.143 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -143.63 -179.09 6.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.677 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -139.79 16.07 2.5 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.339 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.75 -73.58 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.938 0.399 . . . . 0.0 110.32 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -115.12 154.59 28.66 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.008 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.7 m-85 -99.87 171.09 8.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.272 178.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -90.17 143.59 26.63 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.031 0.443 . . . . 0.0 109.935 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.21 116.0 51.38 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.311 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.64 -151.75 6.61 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.91 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 46.3 mt -113.51 149.14 34.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.084 0.469 . . . . 0.0 110.813 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -140.38 140.06 35.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.69 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -74.17 -49.4 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.551 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -83.01 143.85 30.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.834 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.5 p -106.47 -7.81 17.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.707 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 77.3 p -52.88 114.96 1.6 Allowed 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.636 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.75 -157.04 19.67 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.712 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.503 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -120.16 -13.9 8.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.759 0.314 . . . . 0.0 111.338 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 68.4 m -90.63 8.05 36.22 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -178.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -110.84 132.58 54.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.042 0.449 . . . . 0.0 111.241 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.453 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.4 m95 -127.03 116.23 20.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.721 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 10.3 p -78.3 125.18 28.99 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.476 HD12 HG21 ' A' ' 175' ' ' VAL . 3.7 pt -86.92 136.66 22.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.844 0.354 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.5 m80 -128.58 149.04 70.76 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.095 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.645 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 33.9 Cg_endo -65.31 137.07 49.93 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.455 2.103 . . . . 0.0 112.511 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.408 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -78.22 -40.1 38.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.426 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 78.4 p -105.95 -171.21 1.86 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.406 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -95.03 -7.25 40.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.979 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.408 ' NE2' ' N ' ' A' ' 168' ' ' GLN . 1.7 mp0 -72.99 -32.39 65.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.022 0.439 . . . . 0.0 110.883 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.645 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.2 mmp_? -90.25 146.66 24.07 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.499 178.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 51.2 m -130.15 167.22 18.72 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.126 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -66.77 128.79 37.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.337 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 96.11 -13.55 65.76 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.986 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -70.55 156.39 39.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.045 0.45 . . . . 0.0 111.283 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.409 ' HD3' ' CZ ' ' A' ' 13' ' ' PHE . 34.9 mttp -73.91 139.67 45.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.456 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.476 HG21 HD12 ' A' ' 162' ' ' ILE . 93.1 t -89.7 119.53 36.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.213 179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.422 ' HD3' ' CD1' ' A' ' 13' ' ' PHE . 0.1 OUTLIER -83.8 153.71 23.93 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 121.246 0.546 . . . . 0.0 111.516 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 13.6 t -68.6 118.31 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.67 -8.01 29.97 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.276 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -73.14 136.34 44.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.79 0.329 . . . . 0.0 110.802 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 38.6 m-20 -76.98 114.2 15.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.414 HD21 HG13 ' A' ' 175' ' ' VAL . 64.4 mt -99.64 149.25 23.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.755 0.788 . . . . 0.0 112.955 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.493 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 66.3 mt -114.62 112.17 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 176.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.458 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -91.8 139.44 30.67 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.089 0.471 . . . . 0.0 112.156 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.46 HG22 ' CD1' ' A' ' 191' ' ' TYR . 72.7 t -131.88 121.74 47.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.902 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 95.6 p -61.42 120.27 10.15 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.503 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 91.7 t -63.38 -34.03 64.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.319 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.6 p -77.73 -39.33 44.84 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.7 m -113.71 7.39 17.18 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.39 31.29 1.24 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.461 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 22.1 mtt180 -112.7 140.65 47.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.96 0.409 . . . . 0.0 110.812 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 50.8 m-85 -72.91 152.97 41.2 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.428 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 37.4 tp -74.92 77.56 2.16 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.321 -2.103 . . . . 0.0 105.321 175.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -77.5 150.61 34.84 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -174.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.0 tp -100.43 117.81 35.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 113.651 -1.613 . . . . 0.0 107.589 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 43.0 t -111.32 145.7 38.36 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.45 90.17 3.33 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.524 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.37 -175.55 45.49 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.432 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' A' ' 197' ' ' GLY . 9.9 m120 1.16 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.449 0.7 . . . . 0.0 112.459 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 77.3 p -146.13 10.62 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.153 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 67.3 p -125.23 -177.88 4.02 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.992 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.6 m95 -108.23 137.3 46.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 111.206 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.462 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 26.4 m-70 -129.22 172.47 11.42 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.027 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.54 134.7 65.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.246 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -153.06 170.93 19.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.509 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.06 94.47 6.86 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.82 178.18 4.38 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.402 -177.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -86.41 10.97 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -119.5 136.83 54.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.589 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 209' ' ' GLN . 20.4 mt-30 -65.07 176.3 1.31 Allowed 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 122.399 1.095 . . . . 0.0 113.143 -178.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.5 m -169.28 120.43 0.72 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 112.946 -1.933 . . . . 0.0 107.729 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 22.4 mt -74.6 127.58 33.44 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.041 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.428 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.7 m95 -114.34 141.82 47.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.733 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.3 t -108.87 100.44 9.65 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.524 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.773 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.8 t -91.82 102.13 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.682 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.87 141.96 27.65 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.233 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.403 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.76 104.46 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.033 1.822 . . . . 0.0 111.316 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.54 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.202 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.735 0.302 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -118.82 153.31 34.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.811 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 34.4 mt -79.58 122.32 26.35 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 8.8 mmm180 -110.17 157.3 19.54 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.018 0.437 . . . . 0.0 111.272 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 7.6 p -67.79 155.22 39.82 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.889 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.66 -7.89 1.49 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.624 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 69' ' ' LEU . 5.1 m-20 -69.15 137.94 53.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.767 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -84.39 119.38 25.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.0 m -136.15 170.03 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.699 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.4 m -132.14 139.65 49.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.414 176.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.799 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -100.58 119.72 38.97 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.7 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.513 ' NE2' HG21 ' A' ' 52' ' ' THR . 43.6 mt-30 -117.6 163.34 16.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 121.298 0.57 . . . . 0.0 111.374 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.4 p -150.25 144.24 25.46 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.409 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.2 m -87.41 123.29 32.2 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.621 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.576 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.04 121.18 42.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.885 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 27.5 m -124.73 132.91 53.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.938 0.399 . . . . 0.0 111.714 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.3 tt -172.0 148.88 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.644 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.3 m80 58.75 41.44 21.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.43 21.93 11.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.39 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -126.34 150.12 48.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.534 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -135.38 146.47 48.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.91 0.386 . . . . 0.0 110.839 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.601 ' NE2' HD21 ' A' ' 35' ' ' LEU . 9.1 pt20 -158.37 172.01 19.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.763 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -118.7 137.09 53.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.534 178.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.601 HD21 ' NE2' ' A' ' 33' ' ' GLN . 2.2 mt -127.37 140.75 51.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.746 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 53.6 t -104.47 146.97 28.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.926 0.393 . . . . 0.0 110.259 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.9 tp -66.57 112.23 4.03 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.799 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.48 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.32 163.72 13.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.436 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.433 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -167.01 162.72 15.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.912 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.71 144.02 45.7 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.68 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -86.55 18.81 31.76 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.167 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -124.33 146.57 48.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.841 0.353 . . . . 0.0 110.607 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.15 -137.65 18.78 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.434 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -80.89 7.76 9.83 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.655 0.264 . . . . 0.0 110.922 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.18 32.98 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.046 179.669 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.1 mt -78.72 135.43 37.15 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.982 0.42 . . . . 0.0 110.693 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -75.57 150.35 38.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.569 0.699 . . . . 0.0 111.33 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -144.39 -165.84 2.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.502 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 37' ' ' LEU . 35.0 mt -129.99 143.6 50.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.395 0.617 . . . . 0.0 112.238 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -111.93 137.37 50.02 Favored 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.674 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.511 ' HA ' HD23 ' A' ' 35' ' ' LEU . 84.6 p -76.12 145.06 40.26 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.674 HG22 ' HG3' ' A' ' 59' ' ' PRO . 76.0 p -107.96 174.25 5.96 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.399 -0.521 . . . . 0.0 111.756 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.608 ' HB2' ' H ' ' A' ' 58' ' ' VAL . 47.3 t 18.4 58.95 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 114.242 -1.345 . . . . 0.0 112.733 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -96.92 -20.98 17.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.625 179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.553 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 77.2 p -169.46 66.97 0.06 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.408 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HA ' ' N ' ' A' ' 55' ' ' SER . 23.6 pttm -149.56 37.81 0.75 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 122.882 0.473 . . . . 0.0 111.305 0.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.425 ' N ' ' HA ' ' A' ' 53' ' ' SER . 51.4 t30 -167.44 125.23 1.24 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.388 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.608 ' H ' ' HB2' ' A' ' 53' ' ' SER . 0.5 OUTLIER 61.55 167.22 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.52 178.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.674 ' HG3' HG22 ' A' ' 52' ' ' THR . 22.7 Cg_exo -58.67 139.39 90.51 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.162 1.908 . . . . 0.0 111.643 178.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.12 -38.76 94.37 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.172 1.915 . . . . 0.0 111.228 179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -123.76 90.39 3.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.668 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.633 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp -68.91 -28.93 67.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.386 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.9 m -48.43 -49.64 34.38 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.48 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.7 pt -72.67 -16.92 18.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.856 -179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.699 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -99.09 -1.07 40.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.409 -178.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.465 HG22 ' OG ' ' A' ' 124' ' ' SER . 31.3 m -86.18 132.2 34.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 112.187 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -136.41 161.51 35.62 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.043 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.575 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.41 133.66 68.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.751 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.441 HD23 ' CD2' ' A' ' 121' ' ' LEU . 17.9 mt -82.34 65.59 7.55 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.501 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 14.4 mm-40 -44.42 -63.91 0.79 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.4 mm100 -123.78 164.74 18.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.69 0.757 . . . . 0.0 112.742 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.21 86.98 1.03 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.068 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.477 HD13 ' SD ' ' A' ' 81' ' ' MET . 4.2 mt -113.73 156.08 24.44 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.138 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 36.8 t -69.19 149.35 48.69 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 177.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.474 HG12 ' NE2' ' A' ' 79' ' ' GLN . 49.6 t -51.34 -44.4 31.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.074 0.464 . . . . 0.0 110.361 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.4 ttp-105 -56.99 -57.04 14.29 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.985 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -58.14 -43.17 87.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.633 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.5 tp -59.36 -48.02 83.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.076 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.474 ' NE2' HG12 ' A' ' 75' ' ' VAL . 44.8 mt-30 -64.32 -36.2 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.007 0.432 . . . . 0.0 110.584 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.9 -42.08 95.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.033 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.477 ' SD ' HD13 ' A' ' 73' ' ' LEU . 67.9 mtt -65.43 -43.15 91.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.992 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.7 mt -68.44 -31.81 71.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.972 0.415 . . . . 0.0 110.528 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.74 -33.33 70.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.666 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -78.05 -16.33 58.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.532 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 81' ' ' MET . 43.5 p -89.11 -2.05 58.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.797 0.332 . . . . 0.0 111.507 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.5 t -73.33 -22.56 19.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.316 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -61.27 -74.1 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -136.79 -61.85 0.66 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 81.1 p -159.6 -175.41 5.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.757 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.608 ' HG2' ' H ' ' A' ' 92' ' ' GLN . 0.2 OUTLIER -103.04 -33.05 9.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.042 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 61.6 33.48 85.09 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.535 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.608 ' H ' ' HG2' ' A' ' 90' ' ' GLU . 44.4 mt-30 -112.5 7.86 19.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.807 0.337 . . . . 0.0 110.869 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.0 m -64.92 179.94 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.369 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.472 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 6.4 m-20 -71.82 88.49 1.02 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.471 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.88 -10.34 11.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.766 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.768 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 25.1 mm-40 -53.08 -44.89 67.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.723 -179.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.712 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 16.6 ptpt -86.66 -49.63 7.37 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.21 1.404 . . . . 0.0 111.304 -3.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -54.19 -41.48 68.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.161 -1.381 . . . . 0.0 112.854 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.615 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 66.1 tttp -59.56 -31.07 69.08 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.176 -0.61 . . . . 0.0 109.95 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.768 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.1 t80 -73.3 -44.94 58.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.43 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 68.1 mmm -56.79 -46.96 81.21 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.07 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 57.2 ttp -68.84 -42.82 76.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.336 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -57.68 -45.8 85.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.849 0.356 . . . . 0.0 110.856 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.468 HG23 ' HA3' ' A' ' 108' ' ' GLY . 36.5 m -68.54 -43.54 76.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.846 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.59 72.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.859 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -69.77 -54.29 14.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.916 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -163.04 70.48 0.21 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.751 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.468 ' HA3' HG23 ' A' ' 104' ' ' THR . . . -71.68 5.83 10.52 Favored Glycine 0 CA--C 1.518 0.261 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.493 179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -70.91 -151.94 0.88 Allowed Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.449 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -134.75 150.87 50.62 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.019 0.909 . . . . 0.0 110.679 -0.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -166.15 142.71 5.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.095 0.474 . . . . 0.0 111.315 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 80.9 m -74.25 147.18 42.65 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.53 130.48 35.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.0 mt -114.95 141.66 47.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.159 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.94 125.4 23.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.719 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 105.17 -12.28 48.49 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.121 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.41 142.29 32.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.081 0.467 . . . . 0.0 111.237 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.92 126.41 32.45 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.44 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.5 pt -112.19 159.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.449 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 19.1 tp -114.38 109.24 18.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.877 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.441 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.11 116.22 28.92 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.779 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.575 ' NH2' HG21 ' A' ' 68' ' ' VAL . 58.7 ttp85 -101.86 116.5 32.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.715 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 23.4 t-80 -59.8 106.22 0.46 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.465 ' OG ' HG22 ' A' ' 66' ' ' THR . 62.0 m -49.18 -46.5 45.6 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 63.3 t80 -64.06 -64.26 0.94 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.401 ' HG ' ' CE1' ' A' ' 123' ' ' HIS . 14.7 m -72.69 -14.79 61.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 73.1 -1.45 40.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.179 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 49.3 mtt -82.01 -165.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.525 0.203 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 66.6 m-85 -134.6 138.69 44.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.484 HD13 HD21 ' A' ' 37' ' ' LEU . 25.1 tp -54.99 126.14 23.34 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.4 t -134.71 147.77 50.15 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.0 t -95.48 98.12 10.3 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.0 mt -75.02 149.54 39.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -80.84 5.96 14.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.783 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.8 p -90.32 122.83 33.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.737 0.303 . . . . 0.0 111.074 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.423 ' HB3' ' HB2' ' A' ' 141' ' ' ASP . 48.9 m -64.63 -60.59 2.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.8 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -176.62 -60.2 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.672 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.7 p -159.56 -46.16 0.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.527 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.7 p -101.05 -161.64 0.88 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.591 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 38.2 p -57.26 -72.65 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.372 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.423 ' HB2' ' HB3' ' A' ' 136' ' ' SER . 18.0 m-20 59.28 -83.86 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 74.68 -20.88 0.31 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.55 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 141' ' ' ASP . 4.6 mm? -60.24 -80.11 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.809 0.338 . . . . 0.0 110.772 179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -102.17 149.0 24.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.54 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -100.83 170.79 8.08 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.166 177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -89.43 143.76 26.57 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-O 120.995 0.426 . . . . 0.0 109.949 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.4 t -113.49 118.0 56.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.312 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.48 -148.43 5.51 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.98 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.455 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 52.2 mt -115.92 151.29 35.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.077 0.465 . . . . 0.0 110.831 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -141.15 139.94 34.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.579 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -73.35 -52.87 12.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -82.57 147.05 28.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 58.2 p -105.49 -5.03 20.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -55.74 113.08 1.33 Allowed 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.453 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 127.47 -159.61 21.45 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.593 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 36.5 mt-10 -118.79 -13.26 9.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.808 0.337 . . . . 0.0 111.428 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.94 -32.88 66.44 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 64.9 m -91.17 7.19 41.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.19 133.98 52.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.016 0.436 . . . . 0.0 111.253 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.44 ' O ' HG12 ' A' ' 119' ' ' ILE . 57.3 m95 -128.8 117.72 21.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.822 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.433 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 13.6 p -79.08 125.65 29.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.112 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.01 136.11 23.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.94 0.4 . . . . 0.0 110.943 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.9 m80 -128.76 151.41 77.15 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.305 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.704 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.1 Cg_endo -67.51 140.93 53.81 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.598 2.199 . . . . 0.0 112.274 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -44.52 53.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.847 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -110.8 -170.85 1.72 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.248 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.534 ' HE3' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -92.44 9.26 35.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.149 -179.819 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.534 HE22 ' HE3' ' A' ' 167' ' ' LYS . 9.9 mm-40 -83.03 -35.25 25.93 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.548 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.704 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 77.3 mmt-85 -91.96 146.56 23.64 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.299 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 46.1 t -123.95 165.52 17.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.398 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -68.18 129.46 40.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.23 -13.53 64.54 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.851 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -71.49 156.09 39.83 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.937 0.398 . . . . 0.0 111.292 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.401 ' HG2' HG21 ' A' ' 112' ' ' THR . 37.6 mttp -72.81 140.51 47.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.473 HG21 HD12 ' A' ' 162' ' ' ILE . 93.4 t -90.25 120.06 38.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.534 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -83.85 155.64 22.83 Favored 'General case' 0 CA--C 1.498 -1.051 0 CA-C-O 121.344 0.593 . . . . 0.0 111.533 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.429 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.0 t -71.13 120.33 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.08 -11.69 31.67 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.167 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -70.67 129.82 40.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.742 0.306 . . . . 0.0 110.907 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.578 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 5.5 m-20 -71.41 114.81 9.87 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.409 HD21 HG13 ' A' ' 175' ' ' VAL . 69.2 mt -100.43 148.11 25.11 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 50.7 mt -113.64 113.39 43.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -93.12 137.1 32.77 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.167 0.508 . . . . 0.0 112.107 -178.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.436 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.7 t -129.14 121.1 53.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 86.5 p -61.31 124.19 19.9 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.6 t -67.81 -32.25 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.172 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 98.2 p -77.52 -37.75 50.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.5 m -116.58 6.94 13.53 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.55 31.39 1.33 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.575 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.4 mtt85 -111.8 143.69 42.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.827 0.346 . . . . 0.0 110.862 -179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 55.5 m-85 -74.87 154.01 38.41 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -76.14 76.05 2.98 Favored 'General case' 0 N--CA 1.444 -0.775 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 175.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.6 t60 -76.54 149.64 36.65 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -174.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.2 tp -98.75 119.09 36.91 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.966 -1.47 . . . . 0.0 107.614 176.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 44.5 t -113.07 146.74 38.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -177.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -105.46 92.67 4.29 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.497 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -76.03 -170.31 29.62 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.994 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.541 ' ND2' ' H ' ' A' ' 199' ' ' SER . 3.3 p-10 -11.22 -67.57 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.439 0.695 . . . . 0.0 112.812 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.541 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 56.9 m -153.22 12.41 0.48 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 0.0 109.89 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 51.7 m -128.4 -179.8 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.576 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 91.8 m95 -106.5 135.31 48.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.251 0.548 . . . . 0.0 111.245 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.495 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 21.1 m-70 -127.53 173.54 9.78 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.916 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -129.06 128.49 67.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.236 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -144.94 172.09 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.746 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.99 95.98 7.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.39 -179.98 3.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.323 -177.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -88.3 10.21 20.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.903 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 25.1 mt-30 -117.87 137.13 52.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.575 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -67.27 175.7 2.57 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.341 1.067 . . . . 0.0 113.039 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.5 m -168.76 121.65 0.82 Allowed 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 113.065 -1.88 . . . . 0.0 107.748 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 40.6 mt -74.33 130.55 39.9 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.837 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.437 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.2 m95 -118.44 125.32 49.69 Favored 'General case' 0 CA--C 1.503 -0.858 0 CA-C-O 121.416 0.627 . . . . 0.0 111.343 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.6 m -91.08 101.11 13.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.157 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.799 HG22 ' HG ' ' A' ' 22' ' ' LEU . 98.1 t -93.57 103.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.765 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.82 142.24 28.05 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.218 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.447 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.5 Cg_exo -63.6 104.23 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.218 1.946 . . . . 0.0 111.265 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.296 -0.859 . . . . 0.0 111.167 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.591 HE21 ' HA ' ' A' ' 12' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.762 0.315 . . . . 0.0 111.085 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -119.21 154.41 33.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.801 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.28 123.18 27.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -109.49 157.08 19.34 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.016 0.436 . . . . 0.0 111.296 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 6.1 p -67.79 156.08 37.84 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.66 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.15 -9.18 1.18 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.771 -179.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.5 m-20 -67.88 132.61 47.68 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.095 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -79.47 122.28 26.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.1 m -138.26 171.44 15.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.567 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -132.71 136.49 55.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.163 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.76 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.9 mp -97.16 123.87 41.06 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.556 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.697 HE22 ' HB2' ' A' ' 57' ' ' ASN . 35.0 mt-30 -124.78 145.99 49.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.714 0.769 . . . . 0.0 112.326 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.3 p -132.88 143.64 49.65 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.711 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -86.88 120.23 27.94 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.992 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.609 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -109.81 119.2 38.62 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.372 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.3 m -123.66 141.73 51.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.345 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.473 HG12 ' ND1' ' A' ' 29' ' ' HIS . 21.2 tt -170.65 140.03 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.86 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.473 ' ND1' HG12 ' A' ' 28' ' ' ILE . 3.6 p-80 38.46 58.4 1.62 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.517 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 6.5 mmmm 58.27 35.61 25.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.965 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -139.0 113.78 9.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -117.95 148.07 42.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.136 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.461 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -163.01 173.54 13.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.549 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE2' ' NE2' ' A' ' 23' ' ' GLN . 39.1 mtpt -118.56 136.84 53.63 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.668 178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.57 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.98 142.08 51.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.324 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.7 p -105.66 142.12 35.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.072 0.463 . . . . 0.0 110.686 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -63.71 112.9 3.06 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.047 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.469 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.49 164.07 13.72 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.581 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.9 165.0 14.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.597 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -139.44 146.4 40.04 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.656 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.15 10.84 59.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -121.29 153.58 37.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.743 0.306 . . . . 0.0 110.658 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.7 -135.89 15.07 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.779 -0.725 . . . . 0.0 112.318 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -87.13 8.21 24.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.658 0.266 . . . . 0.0 110.87 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.14 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.651 179.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 55.6 mt -80.32 140.44 36.14 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.773 0.32 . . . . 0.0 110.544 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.629 ' SG ' HG13 ' A' ' 203' ' ' VAL . 29.6 p -81.05 150.9 28.64 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 111.112 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -144.4 -166.47 2.39 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.778 -1.101 . . . . 0.0 108.838 179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.545 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 48.3 mt -130.47 144.93 51.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.335 0.588 . . . . 0.0 112.208 -178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.9 mt-10 -110.48 135.33 51.32 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.604 179.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.57 ' HA ' HD23 ' A' ' 35' ' ' LEU . 53.2 m -79.09 132.54 36.63 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.51 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 53.7 p -100.91 170.29 8.4 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.623 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -70.39 -5.98 32.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.427 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 59.91 13.42 3.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.01 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 78.0 p -147.12 80.42 1.52 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.976 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 54.4 mtpt -86.22 -28.6 23.76 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 122.937 0.495 . . . . 0.0 110.918 -0.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.697 ' HB2' HE22 ' A' ' 23' ' ' GLN . 2.1 p-10 -176.07 31.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.034 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.46 107.98 1.55 Allowed Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 2.9 Cg_exo -78.48 140.97 17.44 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.905 2.403 . . . . 0.0 111.161 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -48.94 -40.52 40.3 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.477 2.118 . . . . 0.0 111.405 179.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.407 ' O ' HG12 ' A' ' 64' ' ' ILE . 11.8 t70 -128.27 92.99 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.619 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 HG11 ' A' ' 21' ' ' VAL . 48.5 tp -69.8 -30.66 68.25 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.945 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 55.6 m -51.83 -46.78 64.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.268 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.469 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.3 pt -70.68 -18.72 21.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.472 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 32.5 m -99.9 12.33 37.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.716 0.293 . . . . 0.0 111.073 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -90.14 129.35 36.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 111.841 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -136.17 161.22 36.33 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.148 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.572 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.3 t -125.27 132.21 71.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.612 178.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.8 mt -80.84 65.81 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.507 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 13.2 mm-40 -44.67 -66.9 0.33 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.483 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -121.25 164.24 17.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.611 0.719 . . . . 0.0 112.895 -177.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -154.76 86.55 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.285 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 mt -113.91 154.47 27.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.387 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.2 t -68.58 146.25 53.24 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.0 t -45.86 -49.08 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.187 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.1 ttp85 -52.6 -53.84 41.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.926 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' O ' ' SD ' ' A' ' 81' ' ' MET . . . -57.77 -53.48 57.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.297 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.0 tp -51.49 -45.41 62.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.237 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -65.58 -34.8 79.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.947 0.403 . . . . 0.0 110.284 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.61 -39.05 84.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.715 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.454 ' SD ' ' O ' ' A' ' 77' ' ' ALA . 0.1 OUTLIER -62.33 -47.75 82.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.631 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.16 -34.41 74.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.119 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.23 -31.3 71.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.11 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -73.03 -17.99 61.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 69.8 p -92.98 -3.05 55.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.802 0.334 . . . . 0.0 111.368 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.4 t -75.54 -54.89 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -72.52 96.52 1.95 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.245 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 54.96 -166.04 0.1 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.0 m -95.41 5.43 51.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.942 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -102.39 172.22 7.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.041 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.91 7.77 8.44 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.629 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -94.65 138.17 32.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.797 0.332 . . . . 0.0 110.992 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 13.9 t -77.7 -8.93 12.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.462 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 6.3 m-20 -74.69 81.82 2.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.639 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.7 t -82.94 -4.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.884 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.803 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.7 mm-40 -53.95 -42.69 69.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 118.701 -0.666 . . . . 0.0 112.76 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.763 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 95.3 mttt -86.03 -50.43 7.05 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 120.13 1.332 . . . . 0.0 111.409 -2.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -54.45 -44.14 72.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.082 -1.417 . . . . 0.0 113.057 -177.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.609 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 98.8 mttt -56.07 -34.94 66.43 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.356 -179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.803 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -73.84 -42.48 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.705 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 56.1 tpp -57.33 -41.25 79.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.543 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 54.2 ttp -73.12 -43.03 62.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.554 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 103' ' ' LYS . 4.9 ttmp? -58.05 -42.59 85.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.055 0.455 . . . . 0.0 110.307 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.0 m -72.58 -40.43 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.9 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.86 -39.19 84.39 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.091 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -80.43 -35.68 34.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.587 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.33 -17.61 80.15 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.2 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -71.49 -41.7 57.43 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.426 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -113.15 165.15 12.01 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.469 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -78.4 154.37 30.75 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 117.453 0.626 . . . . 0.0 110.868 0.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 15.0 ptm180 -139.34 140.56 37.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.138 0.494 . . . . 0.0 111.332 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 85.4 m -72.65 147.45 45.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.196 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.55 129.58 34.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.695 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -113.03 143.6 44.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.374 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.503 ' HD2' ' HG2' ' A' ' 173' ' ' GLU . 38.0 m-85 -62.66 143.9 56.86 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.115 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 86.07 -14.99 51.41 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.557 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.496 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.5 OUTLIER -79.81 141.98 35.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.138 0.494 . . . . 0.0 111.611 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.433 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.54 127.18 33.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.226 177.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.9 pt -112.0 162.62 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.575 0.702 . . . . 0.0 112.855 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.483 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.2 tp -117.36 109.95 17.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.96 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.1 mt -98.02 116.25 29.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.767 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.572 ' NH2' HG21 ' A' ' 68' ' ' VAL . 57.9 ttp85 -102.83 116.8 33.26 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.787 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.9 t-80 -59.39 107.1 0.52 Allowed 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.6 t -48.66 -50.26 33.91 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.457 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.5 t80 -61.49 -66.67 0.5 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.422 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.9 p -67.41 -21.36 65.59 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.4 -2.01 68.69 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.157 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -83.06 -165.61 1.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.465 0.174 . . . . 0.0 110.659 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.3 m-85 -134.03 139.66 46.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.6 tp -55.55 125.31 20.45 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.7 t -133.84 148.23 51.28 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 50.5 t -95.07 98.13 10.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.513 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.67 155.75 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.263 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 39.8 t -86.43 6.61 29.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.943 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.8 p -92.32 124.21 36.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.655 0.264 . . . . 0.0 111.081 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 47.1 t -61.51 -58.57 7.63 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.938 0.399 . . . . 0.0 110.806 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -152.9 -65.64 0.16 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 80.0 p -132.86 -24.63 1.91 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.95 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.9 p -137.31 -172.49 3.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.3 p -75.73 110.93 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.189 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.4 156.58 40.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.773 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.9 mttp -79.05 -157.3 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.806 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.48 ' HB3' ' H ' ' A' ' 144' ' ' ALA . 4.3 mm? 60.35 -162.9 0.25 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.189 0.519 . . . . 0.0 111.505 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -40.84 144.98 0.22 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.074 -0.966 . . . . 0.0 113.503 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.4 m-85 -104.79 176.07 5.28 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.433 177.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.41 141.75 28.22 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.593 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 59.9 t -111.21 125.87 68.56 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -141.41 -151.58 5.58 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.562 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 76.8 mt -115.77 143.94 44.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.042 0.448 . . . . 0.0 110.841 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -133.69 141.07 47.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.932 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.14 -64.02 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.54 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -76.89 149.1 36.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.716 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.1 p -103.46 1.32 32.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.948 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.2 p -55.69 114.46 1.88 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 123.73 -161.29 18.13 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.606 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.0 mt-10 -118.2 -11.38 10.12 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.75 0.31 . . . . 0.0 111.146 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.16 -32.83 66.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.04 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 73.4 m -90.21 7.66 37.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.722 -179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -111.17 132.03 54.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.399 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.476 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.9 m95 -127.28 116.42 20.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.676 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 12.8 p -78.85 125.24 29.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.152 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.481 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.03 137.07 21.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.818 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 69.8 m80 -130.8 149.21 73.01 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.264 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.615 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 23.7 Cg_endo -64.36 137.76 57.27 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.323 2.015 . . . . 0.0 112.244 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.1 49.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.742 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 68.6 m -113.15 -167.61 1.21 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 167' ' ' LYS . 8.1 tmtm? -91.41 1.48 57.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.838 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.78 -26.53 34.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.615 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 14.6 mmp_? -94.14 145.67 24.53 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.478 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 173' ' ' GLU . 69.4 m -111.63 152.63 27.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.047 -178.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.523 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.1 OUTLIER -71.72 132.11 44.07 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 79.77 -4.53 64.87 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.541 ' HB3' ' O ' ' A' ' 170' ' ' SER . 0.0 OUTLIER -79.16 154.8 29.02 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.66 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 173' ' ' GLU . 81.5 mttt -59.05 138.32 57.59 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.225 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.481 HG21 HD12 ' A' ' 162' ' ' ILE . 90.1 t -93.75 116.93 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.104 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.432 ' HB2' ' OD2' ' A' ' 179' ' ' ASP . 11.1 mpt_? -80.03 154.01 28.45 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.177 0.513 . . . . 0.0 111.519 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 42.2 t -68.73 122.53 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.277 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 176.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.75 -13.5 35.13 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.23 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 169' ' ' ARG . 71.1 m-20 -68.36 129.1 38.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.79 0.329 . . . . 0.0 110.719 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -71.86 112.81 8.28 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.442 HD21 HG13 ' A' ' 175' ' ' VAL . 65.2 mt -97.29 150.66 20.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.834 0.826 . . . . 0.0 113.158 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.413 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 43.9 mt -115.21 113.97 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.918 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 176.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.99 135.01 35.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.001 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.456 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.0 t -127.55 122.06 58.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.933 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 29.5 t -62.23 122.03 14.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -67.08 -30.86 50.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.025 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.49 -40.0 36.64 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 48.9 m -115.13 7.78 15.47 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.56 31.63 1.4 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 190' ' ' ARG . 4.9 mtt-85 -113.13 142.26 45.96 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.479 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -73.54 153.33 40.32 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.5 tp -75.12 76.33 2.28 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 175.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.496 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.2 t60 -76.32 151.29 36.73 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.93 115.19 29.08 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 113.604 -1.634 . . . . 0.0 107.731 177.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 67.7 m -107.86 147.46 30.91 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -106.72 92.26 4.03 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.512 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.47 -173.46 39.75 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.341 -0.933 . . . . 0.0 111.594 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.512 ' C ' ' O ' ' A' ' 197' ' ' GLY . 10.5 p-10 -5.55 -71.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.415 ' H ' ' CG ' ' A' ' 198' ' ' ASN . 54.3 m -151.97 13.83 0.61 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 31.2 t -127.86 -179.33 4.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.742 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.609 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.3 m95 -108.08 134.99 50.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.223 0.535 . . . . 0.0 111.321 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.484 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 20.4 m-70 -127.51 177.96 6.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.942 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . 0.629 HG13 ' SG ' ' A' ' 47' ' ' CYS . 3.0 p -132.36 130.2 60.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.47 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 54.7 p-10 -146.56 173.97 11.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.632 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.479 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.06 91.76 4.93 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.484 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -110.43 -179.51 3.79 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -87.73 5.03 41.87 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.484 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.496 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 65.8 mt-30 -112.99 137.95 50.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.635 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -64.86 175.23 1.56 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 122.35 1.072 . . . . 0.0 112.852 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.8 m -168.17 119.96 0.83 Allowed 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 112.997 -1.911 . . . . 0.0 107.846 178.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 25.1 mt -74.56 129.34 37.56 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.436 -0.505 . . . . 0.0 109.996 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 99.0 m95 -116.42 145.43 43.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.521 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -112.47 99.86 8.31 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.345 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.76 HG22 ' HG ' ' A' ' 22' ' ' LEU . 86.5 t -91.46 99.98 10.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.573 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.63 140.47 23.92 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 217' ' ' ILE . 27.3 Cg_exo -62.36 103.97 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.097 1.865 . . . . 0.0 111.141 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.568 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.6 mm . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.295 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.466 ' HG2' ' HB ' ' A' ' 177' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.867 0.365 . . . . 0.0 111.037 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -114.42 160.92 18.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.215 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.8 mt -82.85 118.74 23.64 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.429 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.6 mmm180 -107.36 158.13 17.4 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.242 0.544 . . . . 0.0 111.342 -179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.511 ' OG1' ' HB3' ' A' ' 110' ' ' HIS . 3.9 p -68.41 154.44 41.81 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.694 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 72.46 -2.91 2.47 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.786 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.436 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.1 m-20 -73.82 138.44 44.45 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.741 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -84.34 121.18 27.17 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.554 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.7 m -137.5 169.73 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.7 137.04 56.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 114.678 -1.147 . . . . 0.0 108.277 176.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.745 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.3 mp -97.8 123.91 41.96 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.614 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' OE1' ' HB3' ' A' ' 57' ' ' ASN . 23.4 mt-30 -124.56 146.75 48.85 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.544 0.688 . . . . 0.0 112.194 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.23 143.67 49.28 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.746 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 m -86.56 120.48 27.92 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.213 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.62 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.74 121.09 44.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.179 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.8 m -125.75 133.13 52.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.004 0.43 . . . . 0.0 111.775 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.476 HG23 ' CD2' ' A' ' 29' ' ' HIS . 16.9 tt -169.85 146.56 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.382 179.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.476 ' CD2' HG23 ' A' ' 28' ' ' ILE . 37.1 m-70 57.68 43.7 21.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.02 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 0.8 OUTLIER 58.91 23.57 11.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.364 179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.03 144.12 50.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.371 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -132.0 147.6 52.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.917 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -161.35 171.13 18.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.557 ' H ' HD21 ' A' ' 54' ' ' ASN . 21.6 mtpp -118.85 139.12 52.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.381 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.9 144.24 51.1 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.303 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.6 p -108.37 139.83 42.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 0.0 110.693 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.1 tp -62.13 113.23 2.74 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.1 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.37 168.3 9.97 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.597 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -172.74 165.34 5.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.66 150.97 48.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.511 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.26 -0.35 88.58 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.816 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -113.96 153.87 28.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.868 0.366 . . . . 0.0 111.056 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.38 -128.24 8.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.523 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.0 t-20 -91.31 3.87 53.78 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.749 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 43.12 28.81 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.584 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 32.5 mt -81.31 133.87 35.5 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.418 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 76.7 m -72.63 150.2 43.24 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -145.94 -170.39 3.47 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.58 -1.191 . . . . 0.0 108.503 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.489 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.1 mt -129.17 143.28 50.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.497 0.665 . . . . 0.0 112.45 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.4 mt-10 -107.68 138.44 43.9 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.765 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.549 ' HA ' HD23 ' A' ' 35' ' ' LEU . 53.0 m -81.99 133.13 35.28 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 176.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.532 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 49.3 p -103.29 165.13 11.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.686 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 88.5 p -72.49 -7.86 52.13 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.181 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.557 HD21 ' H ' ' A' ' 34' ' ' LYS . 15.6 m120 60.74 12.59 3.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.974 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 71.0 p -156.2 79.47 0.97 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 50.7 mtpt -107.13 91.22 3.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.15 0.58 . . . . 0.0 110.929 -0.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.532 ' C ' ' HB ' ' A' ' 52' ' ' THR . 6.5 m120 56.32 20.59 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.277 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.06 108.63 1.99 Allowed Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.54 139.6 16.28 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.907 2.405 . . . . 0.0 111.157 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -49.08 -39.1 41.25 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.358 2.039 . . . . 0.0 111.542 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -128.42 89.71 2.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.674 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 21' ' ' VAL . 48.9 tp -66.95 -29.24 69.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.168 -178.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.0 m -52.28 -50.22 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 29.8 pt -68.6 -17.34 22.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 51.4 m -100.27 11.4 39.47 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.826 0.346 . . . . 0.0 111.03 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -90.22 130.11 36.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.11 0.481 . . . . 0.0 111.689 -179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -136.45 160.83 37.58 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.102 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.3 t -124.83 132.57 71.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.863 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.436 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.6 mt -80.9 64.33 5.62 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.523 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.6 mm-40 -43.5 -64.02 0.73 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.465 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.5 mm100 -123.18 162.93 21.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.707 0.765 . . . . 0.0 112.888 -177.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.6 m -154.13 84.9 1.14 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.416 -1.266 . . . . 0.0 108.987 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 mt -113.18 154.19 27.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.187 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.54 ' HB3' HH12 ' A' ' 76' ' ' ARG . 47.4 t -67.76 149.1 50.37 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 48.5 t -49.94 -43.86 20.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.88 0.371 . . . . 0.0 110.276 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.54 HH12 ' HB3' ' A' ' 74' ' ' SER . 1.9 tmm_? -58.7 -52.94 63.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.22 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.421 ' N ' HH11 ' A' ' 76' ' ' ARG . . . -59.51 -44.11 93.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.702 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.9 tp -62.24 -48.06 81.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.345 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.74 -32.27 73.72 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.816 0.341 . . . . 0.0 110.543 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -67.2 -41.2 86.2 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.654 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 67.5 mtt -64.11 -45.33 89.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.912 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' O ' HG23 ' A' ' 86' ' ' VAL . 64.0 mt -68.27 -35.47 77.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.0 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.25 -33.37 75.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -67.32 -29.79 69.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.352 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.9 p -76.12 -16.18 59.94 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.277 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 82' ' ' LEU . 23.5 t -84.52 -27.87 6.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.092 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.534 ' HG3' ' HG2' ' A' ' 88' ' ' LYS . 14.1 tp10 -85.46 -79.07 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.534 ' HG2' ' HG3' ' A' ' 87' ' ' GLU . 7.6 ptpp? -170.08 -176.79 2.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.011 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t 63.27 159.49 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.434 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -169.09 172.73 7.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.748 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 110.38 28.29 4.12 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.638 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 60.16 -179.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.884 0.374 . . . . 0.0 111.054 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 20.9 m -87.77 146.99 5.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.003 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.636 ' HA ' ' HD3' ' A' ' 97' ' ' LYS . 16.8 m-20 -121.73 77.54 1.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.888 -179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 48.3 t -71.02 -59.37 3.51 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -178.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.689 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.8 mm-40 -73.31 -51.77 16.31 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.027 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.652 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 25.1 tptp -87.75 -38.2 15.98 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 124.5 1.12 . . . . 0.0 109.942 -4.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -53.62 -44.64 69.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.697 -178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -61.69 -27.7 68.88 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.211 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.689 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 66.4 t80 -74.25 -49.44 23.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.501 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 58.6 ttp -60.66 -38.84 86.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.846 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.1 mtp -72.13 -45.4 60.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.014 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -59.15 -41.07 87.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.837 0.351 . . . . 0.0 110.704 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 55.2 p -71.91 -43.81 64.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.035 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.91 -29.59 70.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.33 -56.43 4.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.797 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.37 -28.57 67.38 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.77 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 113.81 -115.5 3.61 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.433 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.483 ' HA2' ' HA ' ' A' ' 110' ' ' HIS . . . -171.55 146.08 9.23 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.546 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.511 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 37.6 t-80 -152.09 -59.19 0.15 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.915 0.858 . . . . 0.0 110.83 -0.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -162.91 145.89 10.76 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-O 121.373 0.606 . . . . 0.0 112.16 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 93.4 m -81.49 150.55 28.21 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.838 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.42 130.44 35.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.734 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.5 mt -115.49 143.25 45.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.142 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -63.97 129.68 41.03 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.039 0.447 . . . . 0.0 110.49 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.43 -11.71 58.25 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.95 -0.643 . . . . 0.0 111.944 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.01 141.09 31.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.091 0.472 . . . . 0.0 111.388 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -83.02 127.18 33.33 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 177.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 160' ' ' TRP . 40.5 pt -110.99 163.52 7.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.541 0.686 . . . . 0.0 112.602 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.465 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.5 tp -118.81 108.46 14.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.752 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.417 ' CD2' HD23 ' A' ' 69' ' ' LEU . 57.7 mt -96.75 117.47 31.11 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.739 -178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.523 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 18.9 ttp180 -104.02 116.69 32.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.553 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.45 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.8 t-80 -59.82 106.68 0.51 Allowed 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 177.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.7 t -49.83 -45.31 50.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 31.8 t80 -67.01 -59.88 3.11 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.9 m -74.72 -14.74 60.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.26 -2.84 26.05 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.376 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . 0.428 ' HB2' ' HB3' ' A' ' 149' ' ' LEU . 50.1 mtt -82.95 -165.78 1.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.4 m-85 -132.94 138.9 47.07 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 27.2 tp -54.78 126.03 22.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.579 ' SG ' HD21 ' A' ' 133' ' ' LEU . 16.7 p -136.34 148.66 48.0 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.3 t -94.82 97.4 10.01 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 114.455 -1.248 . . . . 0.0 107.726 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.579 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.0 mt -72.89 154.86 40.4 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.458 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 77.4 p -83.0 2.31 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.186 -178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.5 p -95.74 120.97 36.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.78 0.324 . . . . 0.0 111.107 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 78.0 p -67.05 -52.17 45.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.551 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -174.74 -28.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.548 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.0 p -163.37 65.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.653 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 56.2 m 64.25 154.93 0.06 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.282 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 53.4 m 65.7 129.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.481 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.85 130.62 47.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.706 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -142.96 94.14 2.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.493 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 143' ' ' LEU . 4.4 mm? 56.27 -84.62 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.321 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -101.93 154.27 19.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.482 0.658 . . . . 0.0 112.085 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.2 m-85 -100.54 170.24 8.51 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 114.909 -1.042 . . . . 0.0 109.113 177.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -89.38 145.1 25.57 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 72.7 t -113.89 117.14 54.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.529 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.23 -151.54 6.45 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.987 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.9 mt -115.71 141.72 47.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.987 0.423 . . . . 0.0 110.731 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.498 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 2.2 tp60 -130.92 140.72 50.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.695 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -69.86 -69.01 0.37 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.585 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.96 148.41 46.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.685 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.0 p -104.21 0.16 29.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.127 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 79.2 p -55.54 112.77 1.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.436 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 126.17 -160.22 20.57 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.672 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.482 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 32.0 mt-10 -118.95 -10.73 9.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.98 -33.13 66.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 82.5 m -91.84 9.69 31.74 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.18 132.5 54.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 0.0 111.353 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.463 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -128.44 116.66 20.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.728 -178.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.427 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 15.5 p -78.6 126.73 31.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.252 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.496 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.93 136.77 22.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.879 0.371 . . . . 0.0 110.887 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -130.77 150.3 76.06 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.315 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.719 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 39.5 Cg_endo -66.49 141.01 59.52 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.664 2.242 . . . . 0.0 112.295 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -73.52 -46.31 48.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.78 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 21.3 t -113.61 -177.23 3.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.126 -179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.494 ' HD2' HE22 ' A' ' 168' ' ' GLN . 0.0 OUTLIER -85.31 15.23 4.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.281 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.494 HE22 ' HD2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -85.89 -36.25 20.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.196 0.522 . . . . 0.0 110.2 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.719 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.8 mmp_? -93.89 148.23 22.34 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.061 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 49.1 m -125.12 166.71 15.93 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.234 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -66.47 133.44 50.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.186 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 90.83 -12.07 69.95 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.302 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.8 mt-10 -72.42 154.6 40.8 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 120.999 0.428 . . . . 0.0 111.183 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 76.8 mttt -70.42 142.44 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.496 HG21 HD12 ' A' ' 162' ' ' ILE . 85.8 t -92.48 111.88 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.588 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.52 155.29 38.09 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-O 121.435 0.636 . . . . 0.0 111.49 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.466 ' HB ' ' HG2' ' A' ' 12' ' ' GLN . 41.5 t -71.37 120.41 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 176.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.2 -12.37 33.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.261 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -67.88 129.16 39.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.778 0.323 . . . . 0.0 110.859 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.502 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.1 m-20 -69.93 110.65 5.14 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.487 HD21 HG13 ' A' ' 175' ' ' VAL . 70.2 mt -97.28 148.89 22.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.783 0.801 . . . . 0.0 113.088 -178.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 209' ' ' GLN . 52.6 mt -114.16 113.18 43.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.5 mp -93.34 137.51 32.58 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.0 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 78.5 t -129.19 126.85 64.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.61 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 41.2 t -66.09 127.72 33.25 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 99.5 t -71.22 -32.12 46.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.979 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -80.13 -35.69 36.34 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 53.5 m -116.94 4.79 12.85 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 46.42 31.8 1.39 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.409 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 26.1 mtt180 -113.58 141.05 47.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.019 0.437 . . . . 0.0 110.759 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 48.5 m-85 -71.5 153.71 42.01 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.41 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.23 75.61 2.36 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.08 150.36 38.88 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -174.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.3 tp -100.28 116.53 32.47 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 113.667 -1.606 . . . . 0.0 107.632 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.416 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 47.5 t -110.16 146.79 34.9 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -105.26 94.56 5.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.5 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -77.86 -169.51 33.81 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.961 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 197' ' ' GLY . 2.9 p30 -11.54 -66.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.425 0.69 . . . . 0.0 112.714 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 53.1 m -154.62 11.92 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.193 0.52 . . . . 0.0 109.731 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 69.4 m -127.04 -178.69 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.851 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.62 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.64 135.69 48.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.167 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.5 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 16.9 m-70 -128.32 172.99 10.55 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.004 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.9 p -127.2 134.32 66.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.297 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.9 p30 -151.7 172.03 16.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.594 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.86 93.84 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.209 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.04 174.09 6.07 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.191 -177.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -83.08 9.35 10.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.838 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.432 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 41.9 mt-30 -115.01 135.54 54.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.678 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.51 ' NE2' HD13 ' A' ' 182' ' ' ILE . 92.4 mt-30 -65.61 175.56 1.8 Allowed 'General case' 0 CA--C 1.508 -0.659 0 CA-C-O 122.284 1.04 . . . . 0.0 113.028 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.9 m -168.73 122.32 0.85 Allowed 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 113.144 -1.844 . . . . 0.0 107.936 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.502 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 55.1 mt -76.42 127.43 32.83 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.082 0.468 . . . . 0.0 109.969 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.4 m95 -114.81 146.98 40.43 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.682 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.9 t -114.15 100.8 8.65 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.163 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.745 HG22 ' HG ' ' A' ' 22' ' ' LEU . 78.4 t -92.6 102.02 13.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.894 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.74 141.04 25.43 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.113 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.418 ' O ' HG12 ' A' ' 217' ' ' ILE . 25.9 Cg_exo -62.86 103.41 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.129 1.886 . . . . 0.0 111.266 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.554 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.3 -0.857 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.489 ' HG2' ' HB ' ' A' ' 177' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.879 0.371 . . . . 0.0 110.978 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -115.52 157.47 24.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.388 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 22.2 mt -80.18 122.63 27.07 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.456 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 11.2 mmm180 -111.63 157.84 19.95 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.059 0.457 . . . . 0.0 111.215 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.409 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 11.6 p -68.36 155.32 40.04 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.868 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.94 -8.37 1.29 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.639 -179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.456 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 2.7 m-20 -69.07 135.03 50.17 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 12.7 tt0 -80.24 119.03 22.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.53 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.1 m -135.08 171.9 16.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.676 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.05 140.89 45.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.658 -1.156 . . . . 0.0 108.473 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.765 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.7 mp -101.52 121.1 41.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.689 0.281 . . . . 0.0 110.5 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -121.58 152.59 39.08 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 121.536 0.684 . . . . 0.0 111.791 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' HD22 ' A' ' 194' ' ' LEU . 24.3 t -139.05 143.99 38.61 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.741 179.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.3 m -86.33 121.28 28.68 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.39 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.589 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.16 119.92 39.46 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.001 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.6 m -124.86 137.04 54.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.944 0.402 . . . . 0.0 111.582 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.7 tt -173.08 143.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.54 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.8 m80 58.91 37.41 24.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.877 0.37 . . . . 0.0 110.713 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 62.88 25.63 15.17 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.105 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -127.07 122.59 34.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.468 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -114.98 145.18 42.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.332 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.447 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.8 pt20 -157.63 171.15 20.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.563 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -118.56 134.83 54.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.59 178.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.559 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.6 mt -124.47 142.47 51.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.341 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 54.0 t -107.09 141.3 38.54 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.644 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 tp -61.01 113.22 2.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.992 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.458 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -112.15 164.74 12.83 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.271 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.35 162.32 10.32 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.694 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -133.18 146.7 51.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.831 179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.89 3.34 85.86 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.788 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -114.08 152.18 31.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 110.972 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.02 -140.45 23.13 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.725 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.411 HD22 ' HB2' ' A' ' 46' ' ' LEU . 0.6 OUTLIER -78.0 4.69 11.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.621 0.248 . . . . 0.0 111.147 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.25 31.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.158 179.63 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.411 ' HB2' HD22 ' A' ' 44' ' ' ASN . 36.3 mt -77.67 139.72 39.48 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.466 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.0 m -79.58 149.7 31.3 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.564 0.697 . . . . 0.0 111.284 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -145.18 -166.21 2.37 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.555 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.6 mt -130.47 145.21 51.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.438 0.637 . . . . 0.0 112.301 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 0.9 OUTLIER -111.17 135.19 52.05 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.769 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.559 ' HA ' HD23 ' A' ' 35' ' ' LEU . 80.1 p -77.58 138.13 38.97 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 176.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.62 ' O ' ' N ' ' A' ' 54' ' ' ASN . 69.8 p -103.42 129.92 50.64 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.109 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.48 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 p -10.91 63.79 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.62 ' N ' ' O ' ' A' ' 52' ' ' THR . 24.0 t-20 66.97 -9.45 0.36 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.669 ' HA ' ' C ' ' A' ' 56' ' ' LYS . 88.3 p 54.58 101.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.808 0.443 . . . . 0.0 112.009 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.669 ' C ' ' HA ' ' A' ' 55' ' ' SER . 0.1 OUTLIER 55.6 -142.2 0.8 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.921 1.288 . . . . 0.0 111.844 -0.077 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.45 ' C ' ' HB ' ' A' ' 52' ' ' THR . 8.8 p30 -178.12 -19.97 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.898 0.38 . . . . 0.0 110.875 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 21.8 t -63.67 108.91 2.07 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 58' ' ' VAL . 3.9 Cg_exo -78.0 139.95 17.67 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 123.001 2.467 . . . . 0.0 111.022 176.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -51.77 -38.93 68.01 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.331 2.02 . . . . 0.0 111.531 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -126.52 91.07 3.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.74 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.596 HD11 HG11 ' A' ' 21' ' ' VAL . 47.3 tp -69.33 -31.14 69.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.662 -178.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.1 p -49.6 -48.14 49.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.458 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.6 pt -72.67 -17.88 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.908 0.385 . . . . 0.0 111.467 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.676 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.69 -0.67 45.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.118 -179.515 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.486 HG22 ' OG ' ' A' ' 124' ' ' SER . 28.3 m -86.2 132.77 33.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.208 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -137.4 163.08 31.92 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.889 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.544 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.6 t -126.14 133.6 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.719 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.47 HD11 HG11 ' A' ' 20' ' ' VAL . 15.9 mt -82.58 64.35 7.18 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.1 mm-40 -43.7 -61.32 1.44 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -178.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 11.2 mm100 -125.36 164.53 20.19 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 112.893 -177.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -156.64 85.08 0.97 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.893 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.417 HD13 ' SD ' ' A' ' 81' ' ' MET . 3.1 mt -114.9 155.44 26.84 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.279 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.3 p -68.6 148.52 50.37 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.2 t -50.03 -44.16 21.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.161 0.505 . . . . 0.0 110.235 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.0 ttp85 -57.91 -51.2 70.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.236 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.84 -43.06 99.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.706 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.83 -47.11 87.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.988 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -65.33 -35.26 80.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.97 -43.22 93.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.653 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.417 ' SD ' HD13 ' A' ' 73' ' ' LEU . 67.5 mtt -62.41 -44.52 96.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.85 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.0 mt -69.65 -31.81 70.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.99 -31.77 68.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.724 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -67.97 -22.32 65.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.168 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 45.4 p -84.74 -13.54 50.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.167 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.27 -43.29 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.022 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -150.72 105.61 3.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.639 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -74.58 157.02 36.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.986 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 52.6 m -124.97 -63.19 1.18 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.792 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -89.16 -71.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 104.31 34.25 3.7 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.81 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -152.58 132.16 13.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.847 0.356 . . . . 0.0 110.794 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.3 t -96.55 -66.43 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.316 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 97' ' ' LYS . 5.0 m-20 -71.84 89.59 1.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.77 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.404 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.0 t -87.16 -9.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.868 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.814 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 8.2 mm-40 -53.96 -40.58 66.97 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.882 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.781 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 18.9 pttp -86.53 -50.53 6.78 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 120.349 1.431 . . . . 0.0 111.611 -2.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.484 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.6 t-105 -56.55 -39.24 73.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.293 -1.321 . . . . 0.0 113.135 -177.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 51.6 tttp -61.39 -33.75 74.19 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.287 -179.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.814 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 24.5 t80 -73.93 -44.8 53.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.899 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 17.6 tpt -59.37 -39.17 82.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.65 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 53.1 ttp -71.0 -47.37 59.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.849 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -59.06 -45.01 91.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.1 m -66.98 -46.96 73.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.108 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -50.88 72.15 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.189 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -64.67 -36.43 84.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.753 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -72.92 -76.76 0.62 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.452 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 53.86 -123.12 25.65 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.577 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -127.08 -172.27 13.23 Favored Glycine 0 CA--C 1.52 0.393 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.256 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.427 ' CD2' ' H ' ' A' ' 110' ' ' HIS . 7.6 p80 -83.99 -167.69 1.84 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 117.648 0.724 . . . . 0.0 111.215 0.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.409 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 15.6 ptm180 -148.11 152.39 37.24 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.161 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 91.2 m -79.33 145.34 33.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.33 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.54 132.25 35.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.802 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -116.31 142.46 46.81 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.202 179.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -62.56 129.82 42.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.083 0.468 . . . . 0.0 110.473 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.56 -12.21 58.14 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -83.56 140.42 32.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.971 0.415 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.405 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.98 128.31 33.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 160' ' ' TRP . 43.0 pt -112.42 158.62 12.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 112.747 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.432 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.1 tp -114.44 108.98 17.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.88 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.0 mt -97.35 115.6 28.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.691 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.544 ' NH2' HG21 ' A' ' 68' ' ' VAL . 64.9 ttp85 -102.22 116.42 32.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.712 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.471 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.6 t-80 -58.09 108.69 0.63 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.486 ' OG ' HG22 ' A' ' 66' ' ' THR . 67.6 m -50.3 -53.3 29.58 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.471 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 47.8 t80 -56.82 -69.88 0.14 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -178.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -63.96 -31.96 73.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 89.24 -0.54 81.47 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.959 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.9 mtt -83.73 -165.82 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.432 -0.21 . . . . 0.0 110.432 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.49 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.3 m-85 -133.66 138.38 45.86 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.454 HD13 HD21 ' A' ' 37' ' ' LEU . 24.8 tp -54.07 125.96 20.9 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 177.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 47.6 t -135.13 149.93 50.1 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 40.8 t -96.69 97.12 9.1 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.7 mt -74.0 155.93 38.08 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.483 -178.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.3 m -84.93 2.37 43.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.856 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 48.0 p -89.16 124.55 34.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.692 0.282 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.6 p -66.08 -60.54 2.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.759 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.4 -78.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.468 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 72.8 m -161.58 8.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.718 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.412 ' HB3' ' OD2' ' A' ' 141' ' ' ASP . 11.5 t -123.94 -169.16 1.91 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.891 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 10.2 m -88.81 -9.38 51.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.451 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.412 ' OD2' ' HB3' ' A' ' 139' ' ' SER . 3.3 p30 -51.18 153.01 2.13 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.885 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -130.71 10.9 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.589 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.66 -83.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -98.19 152.14 19.69 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 121.414 0.626 . . . . 0.0 111.997 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.3 m-85 -101.9 174.28 6.02 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.93 177.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -93.65 142.55 27.22 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.54 118.68 58.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.45 -149.97 5.91 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.713 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 54.3 mt -115.07 146.73 41.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.074 0.464 . . . . 0.0 110.67 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -138.72 139.72 38.48 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.848 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -69.81 -78.56 0.07 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.692 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.21 146.91 46.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.645 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 120' ' ' LEU . 74.1 p -105.13 5.42 32.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.267 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.9 p -58.35 111.69 1.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.668 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.53 -163.35 19.53 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.937 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.481 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 30.8 mt-10 -116.35 -8.81 11.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.774 0.321 . . . . 0.0 111.261 -179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.84 -32.13 67.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.5 p -93.41 10.27 32.98 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.11 131.71 54.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.1 0.476 . . . . 0.0 111.479 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.438 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.6 m95 -126.63 116.76 21.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.912 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.9 p -78.62 127.09 31.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.167 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.467 HD12 HG21 ' A' ' 175' ' ' VAL . 2.9 pt -88.86 135.02 26.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.947 0.403 . . . . 0.0 110.953 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.429 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.5 m80 -127.26 149.88 70.9 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.217 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.636 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.41 138.07 49.23 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.522 2.148 . . . . 0.0 112.216 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.21 -40.3 52.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.565 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.2 p -108.63 -171.75 1.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.489 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -91.78 -8.0 47.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.203 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -71.42 -34.25 70.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.211 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.636 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 71.3 mmt-85 -89.99 146.3 24.47 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.708 178.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 40.8 t -129.19 168.18 16.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.976 0.417 . . . . 0.0 111.383 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.7 136.16 55.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.96 -17.3 51.85 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.293 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 170' ' ' SER . 24.1 mt-10 -67.3 155.99 37.52 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 120.919 0.39 . . . . 0.0 111.396 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.4 mttt -71.84 144.17 49.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.477 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.467 HG21 HD12 ' A' ' 162' ' ' ILE . 92.8 t -94.89 112.81 28.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.316 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -77.7 155.17 31.46 Favored 'General case' 0 CA--C 1.5 -0.964 0 CA-C-O 121.392 0.615 . . . . 0.0 111.471 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.489 ' HB ' ' HG2' ' A' ' 12' ' ' GLN . 53.0 t -69.2 121.82 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.72 -17.15 33.33 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.291 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -63.27 127.02 29.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.738 0.304 . . . . 0.0 110.824 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.6 m-20 -69.88 112.89 6.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -98.19 149.01 23.01 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.429 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 48.6 mt -113.56 113.23 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.5 136.17 33.44 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.257 0.551 . . . . 0.0 112.354 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.442 HG22 ' CD1' ' A' ' 191' ' ' TYR . 70.8 t -129.03 125.25 62.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.545 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 45.4 t -64.5 126.55 28.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.77 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.481 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.9 t -69.77 -33.93 58.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.991 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.6 t -79.36 -36.32 39.54 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 56.3 m -116.3 5.45 13.6 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 47.07 31.26 1.53 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 31.4 mtt85 -112.04 142.67 44.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.899 0.38 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.9 m-85 -74.29 153.56 39.31 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.9 tp -75.86 76.82 2.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.265 -2.124 . . . . 0.0 105.265 175.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.405 ' HA ' ' OG1' ' A' ' 210' ' ' THR . 82.0 t60 -76.44 149.32 36.86 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 -174.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.569 HD22 ' SG ' ' A' ' 24' ' ' CYS . 11.4 tp -100.33 114.64 28.3 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 113.686 -1.597 . . . . 0.0 107.634 177.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.406 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 41.6 t -107.17 147.33 30.23 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -106.45 91.39 3.68 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.538 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -76.14 -174.19 37.13 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.496 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 80.3 m-20 -5.6 -75.87 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.243 0.617 . . . . 0.0 112.457 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 35.8 t -146.32 14.4 1.27 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.097 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 59.3 m -128.33 -179.83 5.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.996 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.589 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.4 m95 -107.89 135.48 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.23 0.538 . . . . 0.0 111.243 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.538 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 17.3 m-70 -128.2 174.92 8.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.881 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.7 p -129.29 133.16 66.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.35 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -150.77 173.07 14.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.669 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.37 96.24 7.58 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.71 -179.5 3.67 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -88.44 10.72 19.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.424 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -118.99 134.88 54.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.058 0.456 . . . . 0.0 110.72 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -61.31 175.09 0.6 Allowed 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.364 1.078 . . . . 0.0 112.844 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . 0.41 HG23 ' SG ' ' A' ' 24' ' ' CYS . 22.8 m -168.65 119.35 0.76 Allowed 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 112.979 -1.918 . . . . 0.0 107.782 178.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 50.7 mt -74.19 128.89 36.71 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.024 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.4 m95 -116.12 146.31 42.34 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.466 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -113.78 100.55 8.54 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.304 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.765 HG22 ' HG ' ' A' ' 22' ' ' LEU . 95.6 t -92.88 100.55 11.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.19 141.8 26.97 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.074 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.413 ' HD3' HG13 ' A' ' 177' ' ' VAL . 26.8 Cg_exo -62.42 103.88 0.33 Allowed 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.192 1.928 . . . . 0.0 111.265 178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.53 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.5 mm . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.135 -0.936 . . . . 0.0 111.311 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.986 0.422 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -120.2 150.36 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.43 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.92 129.58 38.18 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.3 mmt85 -117.4 157.38 26.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.098 0.475 . . . . 0.0 111.103 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 9.1 p -67.95 155.08 40.25 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.726 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.07 -7.8 1.43 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.699 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.9 m-20 -69.33 133.05 47.37 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.836 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.32 121.16 25.31 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.495 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 22.1 m -136.07 173.0 14.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.61 HG11 HD11 ' A' ' 62' ' ' LEU . 3.1 m -134.93 136.74 51.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.169 176.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.761 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -98.06 124.86 42.77 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.655 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.605 HE22 ' HB2' ' A' ' 57' ' ' ASN . 71.9 mt-30 -124.91 145.01 50.03 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 121.664 0.745 . . . . 0.0 112.295 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.7 p -131.42 146.11 52.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.882 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -88.16 123.49 32.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.373 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.627 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.37 120.03 38.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.304 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.8 m -125.17 136.51 53.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.934 0.397 . . . . 0.0 111.685 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.0 tt -173.8 143.64 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.564 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 49.0 m80 61.15 32.63 19.57 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.734 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mmmm 67.74 22.31 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.075 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -126.06 124.61 41.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.511 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.16 147.28 41.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.208 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -158.21 172.98 17.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 23.1 mtmm -120.4 136.02 54.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.1 mt -125.3 145.28 50.08 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.391 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 28.9 p -107.42 140.09 40.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.08 0.467 . . . . 0.0 110.622 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -62.75 111.62 2.18 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.072 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.69 166.05 11.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.461 -179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.2 163.09 15.45 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.31 149.94 46.14 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.66 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.1 -5.25 89.32 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.755 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -107.39 157.35 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 0.0 110.938 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.16 -141.57 23.32 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.368 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -83.34 9.54 10.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.683 0.278 . . . . 0.0 110.705 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.48 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.28 29.78 0.25 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.124 179.705 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.4 mt -80.01 139.41 36.99 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.819 0.342 . . . . 0.0 110.512 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 147' ' ' VAL . 31.5 p -78.71 148.15 33.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.364 0.602 . . . . 0.0 111.031 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -141.25 -165.57 1.99 Allowed 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.001 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.528 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 29.7 mt -131.97 146.22 51.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.293 0.568 . . . . 0.0 112.374 -178.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 3.8 mt-10 -111.6 134.57 53.09 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.718 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.598 ' HA ' HD23 ' A' ' 35' ' ' LEU . 81.4 p -77.75 130.39 36.68 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.57 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 70.5 p -103.09 170.4 7.99 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.3 m -72.8 11.48 0.66 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.44 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 52' ' ' THR . 25.0 t-20 66.31 -78.93 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.453 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 46.8 t -129.67 98.92 4.96 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.81 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.511 ' HB3' HG23 ' A' ' 58' ' ' VAL . 62.2 tttm -72.33 163.11 28.52 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.127 0.571 . . . . 0.0 110.842 0.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.605 ' HB2' HE22 ' A' ' 23' ' ' GLN . 23.3 p30 -81.44 42.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.511 HG23 ' HB3' ' A' ' 56' ' ' LYS . 61.9 t -64.21 111.72 6.09 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 58' ' ' VAL . 3.0 Cg_exo -78.74 140.17 16.28 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.831 2.354 . . . . 0.0 110.906 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -48.65 -38.99 37.67 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.338 2.025 . . . . 0.0 111.619 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -134.02 97.19 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.562 178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.61 HD11 HG11 ' A' ' 21' ' ' VAL . 49.2 tp -71.75 -30.39 65.54 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.141 -178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.4 m -50.94 -44.31 60.37 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 38' ' ' ALA . 23.3 pt -73.07 -20.67 18.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 56.4 m -97.54 12.75 32.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.81 0.338 . . . . 0.0 110.948 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 37.6 m -91.31 128.29 37.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.145 0.498 . . . . 0.0 111.729 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -136.09 161.53 35.45 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.129 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.589 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -125.46 132.43 71.0 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.5 mt -80.71 66.56 6.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 16.3 mm-40 -45.68 -64.78 0.66 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.439 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.4 mm100 -122.12 163.08 20.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.705 0.764 . . . . 0.0 112.826 -177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.3 m -154.69 85.9 1.12 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.427 -1.26 . . . . 0.0 108.771 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.9 158.09 20.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.538 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 87.9 p -70.49 146.49 50.21 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 50.7 t -48.63 -44.25 14.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.099 0.476 . . . . 0.0 110.539 179.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.8 ttp85 -57.98 -53.11 61.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.3 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.27 -43.3 96.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.769 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 13.4 tp -62.03 -47.54 84.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.306 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 51.9 mt-30 -64.36 -35.99 82.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.728 0.299 . . . . 0.0 110.741 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -65.08 -43.38 92.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.868 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.8 mtt -61.95 -43.42 98.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.693 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 86' ' ' VAL . 81.7 mt -69.86 -32.97 71.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.845 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.91 -31.42 69.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.788 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -76.29 -18.06 59.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.537 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 70.8 p -88.65 -7.51 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.845 0.355 . . . . 0.0 111.182 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 82' ' ' LEU . 23.5 t -79.84 -31.78 13.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.717 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -94.36 -60.33 1.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.748 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -113.06 128.26 56.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.917 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.0 m -61.96 -73.01 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.944 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -132.13 -80.2 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.988 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.29 20.01 68.97 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.461 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -117.73 150.83 38.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.857 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -136.56 137.0 48.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.958 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.544 ' HB3' ' HG2' ' A' ' 96' ' ' GLU . 5.8 m-20 -73.96 93.78 2.26 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.078 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 9.3 p -77.63 2.52 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 121.246 0.546 . . . . 0.0 110.84 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.695 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.5 OUTLIER -52.41 -50.14 63.1 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.715 -179.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.695 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 84.9 mttt -89.84 -56.02 3.4 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-O 123.229 1.49 . . . . 0.0 108.547 -5.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 101' ' ' MET . 76.4 m95 -77.06 -27.44 54.32 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 112.661 -2.063 . . . . 0.0 111.66 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -56.05 -58.76 6.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.895 -178.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.586 ' HB3' ' HG3' ' A' ' 96' ' ' GLU . 2.5 t80 -77.26 -33.46 55.92 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.838 178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.469 ' HB3' ' HA ' ' A' ' 98' ' ' TRP . 1.8 tmt? -56.31 -49.52 74.07 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.395 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.8 mtm -74.66 -43.41 55.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.663 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -57.15 -43.63 82.67 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.829 0.347 . . . . 0.0 110.963 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 79.9 m -72.58 -46.78 52.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.31 -34.46 66.54 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.366 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -89.04 -30.41 18.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.003 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.04 -62.53 4.4 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.575 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 79.82 -76.61 1.99 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.415 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.43 -172.13 14.26 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.352 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -151.46 160.92 43.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 117.547 0.674 . . . . 0.0 110.335 -0.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.407 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 20.1 ptp180 -168.12 152.24 6.18 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.036 0.445 . . . . 0.0 111.336 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.404 HG21 ' HG2' ' A' ' 174' ' ' LYS . 86.2 m -79.93 145.27 32.73 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.105 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.29 131.19 35.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.659 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -115.34 142.7 46.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.199 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -62.81 134.44 56.25 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.053 0.454 . . . . 0.0 110.5 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.06 -14.4 63.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.986 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -81.53 141.1 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.085 0.469 . . . . 0.0 111.361 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.72 128.41 34.34 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.156 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -113.11 160.43 12.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.638 0.732 . . . . 0.0 112.73 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.439 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.2 tp -116.52 108.82 16.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.94 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.3 mt -96.62 116.45 29.12 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.675 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.589 ' NH2' HG21 ' A' ' 68' ' ' VAL . 55.1 ttp85 -102.49 116.95 33.65 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.749 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.445 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.5 t-80 -59.2 107.6 0.57 Allowed 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 177.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 35.1 t -48.47 -54.78 12.95 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.445 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.1 t80 -56.82 -70.05 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.415 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.6 p -63.18 -28.81 70.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 86.83 -5.44 84.98 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.92 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.0 mtt -80.18 -165.36 0.83 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.446 0.165 . . . . 0.0 110.703 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.46 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.3 m-85 -134.02 140.21 46.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -178.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.1 tp -55.36 126.25 24.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.0 t -135.18 148.28 49.64 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.1 t -94.83 97.92 10.38 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -75.32 147.37 40.21 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.447 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.0 t -78.34 2.35 18.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.587 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 40.5 p -87.97 121.67 30.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.097 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.468 ' HB2' ' HA ' ' A' ' 141' ' ' ASP . 47.2 t -62.41 -60.41 3.6 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.578 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -172.42 70.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.852 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 88.1 p 48.02 31.16 2.31 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.218 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.0 p -162.88 -162.64 0.79 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.044 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 33.7 m -53.97 148.42 10.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.329 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.468 ' HA ' ' HB2' ' A' ' 136' ' ' SER . 2.8 p-10 -60.24 147.66 39.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.962 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.516 ' HG2' ' H ' ' A' ' 143' ' ' LEU . 11.7 ttmm -147.36 -157.56 0.82 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.83 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.516 ' H ' ' HG2' ' A' ' 142' ' ' LYS . 3.8 mm? -57.67 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.042 0.449 . . . . 0.0 111.524 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -84.19 151.68 24.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.835 -178.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.519 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 13.4 m-85 -102.69 174.26 5.97 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.963 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -93.32 141.78 28.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.167 -0.469 . . . . 0.0 109.861 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 47' ' ' CYS . 60.9 t -111.31 125.97 68.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -144.15 -150.69 5.3 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.757 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 66.5 mt -114.62 144.55 43.23 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.149 0.5 . . . . 0.0 110.969 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -137.29 137.95 39.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.677 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.45 -76.15 0.08 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.48 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -63.89 146.46 53.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.611 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 71.7 p -103.33 -0.66 29.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.035 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.8 p -54.97 112.26 1.01 Allowed 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.411 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 130.12 -161.55 23.08 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.52 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.3 mt-10 -118.68 -15.25 9.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.84 0.352 . . . . 0.0 111.493 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.25 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.1 m -88.05 5.45 40.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.62 0.248 . . . . 0.0 111.613 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -110.88 132.69 53.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.103 0.478 . . . . 0.0 111.261 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.458 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.5 m95 -127.34 117.77 22.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.704 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.404 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 11.2 p -79.26 126.46 30.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.111 178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.498 HD12 HG21 ' A' ' 175' ' ' VAL . 3.6 pt -88.5 135.13 26.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.932 0.396 . . . . 0.0 110.976 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.436 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.9 m80 -127.71 151.65 75.71 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.209 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.728 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.7 Cg_endo -68.07 140.31 49.36 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.519 2.146 . . . . 0.0 112.454 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.12 -47.27 52.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.843 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.458 ' HB3' ' NE2' ' A' ' 168' ' ' GLN . 62.2 m -111.82 -170.96 1.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.238 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.2 15.24 12.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.093 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.458 ' NE2' ' HB3' ' A' ' 166' ' ' SER . 2.4 mp0 -86.75 -35.18 19.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.21 0.529 . . . . 0.0 110.367 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -94.54 153.74 17.74 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.176 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.3 m -133.93 166.86 21.72 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.885 0.374 . . . . 0.0 111.342 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.03 132.2 48.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.524 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.39 -16.35 60.11 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.2 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -68.73 157.97 35.23 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.003 0.43 . . . . 0.0 111.158 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.404 ' HG2' HG21 ' A' ' 112' ' ' THR . 38.9 mttp -74.12 143.13 45.47 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 178.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.498 HG21 HD12 ' A' ' 162' ' ' ILE . 99.5 t -93.17 115.05 31.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.265 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.7 mpt_? -78.93 155.01 29.2 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-O 121.298 0.571 . . . . 0.0 111.615 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 39.0 t -69.42 121.13 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.318 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.47 -11.95 36.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.374 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -68.2 127.62 33.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.764 0.316 . . . . 0.0 110.731 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.585 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.0 m-20 -69.7 110.36 4.85 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.489 HD21 HG13 ' A' ' 175' ' ' VAL . 71.2 mt -96.37 148.54 22.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.757 0.789 . . . . 0.0 113.127 -178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.436 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 54.5 mt -113.53 112.86 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.919 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 176.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.8 mp -92.82 138.26 31.64 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 121.157 0.504 . . . . 0.0 112.052 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 191' ' ' TYR . 77.9 t -130.33 120.45 48.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.001 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 99.9 p -61.04 123.01 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.626 178.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 89.3 t -66.59 -33.19 61.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.8 t -76.04 -39.96 54.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.475 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 49.7 m -113.95 5.37 16.14 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -177.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 47.91 29.86 1.79 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 179.687 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.487 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 34.8 mtt85 -110.34 143.21 40.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.899 0.381 . . . . 0.0 110.838 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.496 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 56.5 m-85 -74.53 153.83 38.9 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.406 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.4 tp -75.68 76.22 2.67 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 105.322 -2.103 . . . . 0.0 105.322 175.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 82.1 t60 -76.4 151.79 36.46 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -174.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 11.7 tp -101.12 116.21 32.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 113.604 -1.635 . . . . 0.0 107.537 177.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.405 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 46.8 p -109.0 146.95 33.06 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -177.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -105.77 91.08 3.6 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.55 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -77.32 -174.17 40.62 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.329 -0.938 . . . . 0.0 111.594 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.53 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.7 m120 -3.09 -76.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.341 0.656 . . . . 0.0 112.496 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.0 p -147.39 14.3 1.1 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.064 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.2 t -128.12 -179.7 5.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.627 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.2 m95 -107.36 135.22 49.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.265 0.555 . . . . 0.0 111.294 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.55 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.7 m-70 -127.93 176.79 7.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.01 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . 0.587 HG13 ' SG ' ' A' ' 47' ' ' CYS . 2.7 p -131.47 131.51 62.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.337 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.93 173.93 12.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.552 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.496 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.92 96.1 7.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.416 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.86 -179.51 3.65 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.252 -177.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -87.97 7.21 32.14 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.415 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 39.3 mt-30 -115.39 136.21 53.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.452 . . . . 0.0 110.687 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.42 ' NE2' HD13 ' A' ' 182' ' ' ILE . 96.7 mt-30 -64.57 174.68 1.65 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-O 122.371 1.081 . . . . 0.0 112.695 -178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 28.2 m -166.61 119.38 1.02 Allowed 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 113.093 -1.867 . . . . 0.0 107.826 178.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 47.7 mt -73.16 128.82 36.58 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.514 -0.474 . . . . 0.0 109.948 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.435 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.3 m95 -116.2 145.05 43.41 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.596 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.8 t -112.02 100.49 8.91 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.761 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.3 t -92.52 100.66 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.75 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.25 27.73 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.087 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 215' ' ' ALA . 25.5 Cg_exo -63.53 104.33 0.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.071 1.847 . . . . 0.0 111.029 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.495 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 5.7 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.348 -0.834 . . . . 0.0 111.368 -179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.871 0.367 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -120.7 153.13 37.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.53 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.4 mt -78.16 124.37 27.98 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.8 mmm180 -111.49 158.03 19.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.982 0.42 . . . . 0.0 111.087 -179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 p -68.09 155.23 40.01 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.889 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.1 -7.3 1.34 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.676 -179.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.2 m-20 -68.3 136.16 53.03 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.064 0.459 . . . . 0.0 110.974 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 13.5 tt0 -82.81 119.53 24.48 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.557 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.5 m -136.29 173.12 14.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.668 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -134.63 139.48 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.278 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.746 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -99.97 120.56 39.99 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.672 0.272 . . . . 0.0 110.67 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.451 HE22 ' CG ' ' A' ' 57' ' ' ASN . 59.4 mt-30 -123.07 142.14 51.2 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.454 0.645 . . . . 0.0 112.185 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' HD22 ' A' ' 194' ' ' LEU . 19.6 t -127.92 146.66 50.57 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.866 178.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.0 m -87.98 122.34 31.47 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.267 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.613 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.76 122.64 47.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.347 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.2 m -125.68 140.21 52.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.447 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 tt -175.48 139.45 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.761 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.8 m80 57.86 43.19 21.99 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.907 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 60.27 23.73 13.14 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.296 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -126.52 123.13 37.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.607 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -117.53 151.25 37.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.195 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.45 ' HB2' HD21 ' A' ' 54' ' ' ASN . 2.9 pt20 -163.36 172.7 14.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.79 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HE3' HD22 ' A' ' 57' ' ' ASN . 29.2 mtmm -118.98 138.09 53.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.583 178.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.1 mt -129.1 139.1 52.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.311 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.579 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 45.3 t -102.09 145.85 28.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.879 178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.7 tp -66.9 116.83 8.19 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.755 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.44 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . . . -116.48 162.44 17.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.591 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.22 165.56 21.87 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.753 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.58 144.49 39.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.569 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.91 51.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.436 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -123.24 147.59 46.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.847 0.356 . . . . 0.0 110.639 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.12 -139.81 21.58 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.411 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.471 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -78.85 4.66 13.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.72 0.295 . . . . 0.0 110.779 179.763 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.48 32.42 0.23 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.908 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.471 ' H ' HD22 ' A' ' 44' ' ' ASN . 40.4 mt -77.6 139.97 39.59 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.032 0.444 . . . . 0.0 110.472 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.6 m -79.73 151.14 30.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.556 0.693 . . . . 0.0 111.347 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -147.05 -167.85 2.89 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.716 -1.129 . . . . 0.0 108.622 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 17.7 mt -131.0 145.67 52.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 112.321 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 46.5 mt-10 -109.07 133.76 52.57 Favored 'General case' 0 CA--C 1.494 -1.192 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.921 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.561 ' HA ' HD23 ' A' ' 35' ' ' LEU . 29.9 t -77.15 121.28 23.4 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.556 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 53.4 p -93.62 160.62 14.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.056 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.5 t -59.67 -19.93 52.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.836 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.524 ' H ' ' HA ' ' A' ' 57' ' ' ASN . 49.4 m-20 56.15 85.65 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.055 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.541 ' H ' ' C ' ' A' ' 56' ' ' LYS . 8.1 m -160.39 -67.75 0.07 Allowed 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 117.446 -1.264 . . . . 0.0 112.924 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 55' ' ' SER . 22.8 mtmt 48.34 77.58 0.09 Allowed 'General case' 0 C--N 1.369 1.42 0 C-N-CA 128.226 2.61 . . . . 0.0 114.598 -0.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.575 HD22 ' HE3' ' A' ' 34' ' ' LYS . 16.3 p30 -92.1 54.68 2.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.648 179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 44.1 t -64.14 111.95 6.54 Favored Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.453 ' CA ' HG22 ' A' ' 52' ' ' THR . 7.8 Cg_exo -75.36 142.09 26.4 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.816 2.344 . . . . 0.0 110.832 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 51' ' ' SER . 3.3 Cg_endo -46.01 -36.08 15.44 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.662 2.241 . . . . 0.0 111.711 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -140.28 92.98 2.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.226 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 21' ' ' VAL . 57.4 tp -64.72 -32.59 74.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.836 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.523 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.2 t -51.58 -52.7 45.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.68 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 38' ' ' ALA . 37.9 pt -71.57 -14.46 17.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.668 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.53 -3.26 46.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.428 0.632 . . . . 0.0 110.059 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.492 HG22 ' OG ' ' A' ' 124' ' ' SER . 37.7 m -84.77 134.11 34.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.123 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -137.66 162.13 34.65 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.782 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.582 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -125.62 133.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.733 178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 19.4 mt -82.32 63.77 6.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.5 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.5 mm-40 -43.7 -61.03 1.53 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -178.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.402 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 11.0 mm100 -124.97 163.93 21.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.708 0.766 . . . . 0.0 112.977 -177.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -156.32 84.38 0.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.363 -1.29 . . . . 0.0 108.995 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 mt -112.45 154.83 25.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.367 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.4 p -67.88 147.12 52.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.428 ' O ' ' HG3' ' A' ' 79' ' ' GLN . 54.7 t -49.44 -44.99 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.088 0.47 . . . . 0.0 110.354 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -56.65 -54.21 48.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.227 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.77 97.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.9 tp -59.78 -49.3 78.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.065 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 75' ' ' VAL . 24.4 mt-30 -62.76 -36.8 84.25 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.755 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -64.6 -44.04 91.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.568 . . . . 0.0 109.946 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.7 mtt -62.01 -42.34 99.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.835 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.0 mt -68.92 -32.36 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.204 0.526 . . . . 0.0 110.36 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.57 69.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.661 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -76.1 -19.6 58.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.641 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 64.5 p -84.25 -6.41 59.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 0.0 111.296 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -79.6 -29.23 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.061 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -129.77 121.55 27.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 68.7 mttm 57.52 -168.16 0.12 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.986 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 65.6 m 61.99 105.98 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.082 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.53 169.51 17.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.074 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.22 31.63 41.72 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.93 -0.653 . . . . 0.0 112.829 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -68.6 -21.19 64.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 110.634 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.69 150.14 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.162 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 97' ' ' LYS . 6.9 p-10 -88.19 81.28 7.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.845 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.443 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 7.3 p -80.67 -1.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.719 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.787 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 5.3 mm-40 -53.72 -39.54 65.34 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.787 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -87.06 -50.77 6.42 Favored 'General case' 0 C--N 1.352 0.69 0 CA-C-N 120.45 1.477 . . . . 0.0 111.624 -2.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.635 ' H ' ' HG2' ' A' ' 97' ' ' LYS . 4.7 m-90 -66.24 -28.68 68.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.941 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.685 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -61.17 -39.47 90.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.174 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.737 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 36.3 t80 -74.28 -42.24 59.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.785 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 16.6 tpt -56.64 -49.42 75.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.932 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.2 mtm -71.54 -38.04 71.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.093 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -57.56 -45.76 84.75 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.859 0.361 . . . . 0.0 110.512 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.7 p -72.96 -39.28 66.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.701 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.02 69.07 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.074 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -91.75 -35.61 14.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.753 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -77.31 -18.15 78.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.266 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -139.31 61.89 0.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.953 -0.642 . . . . 0.0 112.476 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 157.69 166.7 17.53 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.395 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -75.65 -178.2 4.06 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.596 0.698 . . . . 0.0 110.83 -0.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -156.84 143.92 18.72 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.073 0.463 . . . . 0.0 111.533 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.408 HG21 ' HG2' ' A' ' 174' ' ' LYS . 93.3 m -75.76 148.09 38.77 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.052 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -81.34 131.63 35.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.837 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.424 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 77.9 mt -116.03 141.55 47.97 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.218 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -61.56 130.71 47.26 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.458 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.31 -12.7 60.15 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.037 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -82.99 141.53 32.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.12 0.485 . . . . 0.0 111.27 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.58 127.77 33.67 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 160' ' ' TRP . 47.4 pt -112.77 159.42 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.556 0.693 . . . . 0.0 112.746 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.402 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.1 tp -115.07 109.7 18.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.783 -1.099 . . . . 0.0 109.864 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.9 mt -97.4 116.97 30.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.629 -179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.582 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.4 ttp85 -103.4 116.01 31.61 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.777 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.489 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.5 t-80 -58.27 108.16 0.58 Allowed 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 177.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.492 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -51.72 -48.33 63.64 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.523 ' HD1' ' HG ' ' A' ' 63' ' ' SER . 68.7 t80 -61.21 -64.63 0.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.439 ' OG ' HD13 ' A' ' 149' ' ' LEU . 53.4 p -72.12 -19.87 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.9 -0.19 73.06 Favored Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.236 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.6 mtt -83.32 -165.5 1.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.411 0.148 . . . . 0.0 110.636 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.478 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 67.2 m-85 -133.75 138.53 45.81 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.401 HD13 HD21 ' A' ' 37' ' ' LEU . 22.1 tp -55.39 127.4 29.35 Favored 'General case' 0 CA--C 1.512 -0.486 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 177.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.586 ' SG ' HD21 ' A' ' 133' ' ' LEU . 20.5 p -137.02 150.01 47.83 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 54.0 t -95.36 99.53 11.45 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.589 -1.264 . . . . 0.0 107.589 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.586 HD21 ' SG ' ' A' ' 131' ' ' CYS . 15.2 mt -75.45 152.74 37.89 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.888 -178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.6 p -78.53 -5.71 53.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.81 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 31.1 p -85.32 124.16 31.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.729 0.299 . . . . 0.0 110.884 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 51.6 m -66.74 -60.9 2.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.864 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 179.34 -43.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.593 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 p -155.52 19.6 0.4 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.667 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.2 m 61.93 14.62 6.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.192 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 76.5 p -96.73 -5.94 37.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.882 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -148.38 169.41 20.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.985 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -134.29 2.91 3.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.995 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.05 -83.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -97.28 151.93 19.39 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.308 0.575 . . . . 0.0 111.948 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.506 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.0 m-85 -101.23 172.46 6.99 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.029 177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -91.06 142.93 27.23 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 62.9 t -111.48 117.52 55.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.383 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.35 -150.28 5.99 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.082 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.6 mt -115.14 146.36 41.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.036 0.446 . . . . 0.0 111.029 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.482 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 7.2 tp60 -137.62 143.65 41.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.705 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.37 -50.75 12.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -81.82 143.25 31.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.673 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 77.6 p -106.49 -6.66 17.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 110.978 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 66.8 p -54.84 114.23 1.64 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.46 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.28 -158.15 21.51 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.462 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.469 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.4 mt-10 -121.11 -12.48 8.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.765 0.317 . . . . 0.0 111.357 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.57 -32.15 68.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.122 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 79.7 m -90.86 6.2 45.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.718 0.295 . . . . 0.0 111.593 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -110.07 134.07 52.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.015 0.436 . . . . 0.0 111.365 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.474 ' O ' HG12 ' A' ' 119' ' ' ILE . 51.7 m95 -128.02 117.41 21.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.611 -179.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.429 HG23 HG22 ' A' ' 186' ' ' VAL . 13.5 p -78.84 125.89 29.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.057 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.48 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.13 136.17 23.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.919 0.39 . . . . 0.0 110.89 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.42 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.23 150.17 73.29 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.662 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.5 Cg_endo -66.16 137.58 48.51 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.377 2.051 . . . . 0.0 112.407 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.51 -40.93 41.13 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.289 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 58.6 m -103.49 -173.55 2.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.406 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.406 ' O ' ' HD3' ' A' ' 167' ' ' LYS . 14.0 tmtt? -95.22 -2.12 50.27 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.931 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.09 -33.31 44.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.035 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.662 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 58.7 mmt-85 -86.88 144.86 26.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.606 178.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 48.8 m -127.23 167.93 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.327 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.7 134.21 51.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 91.13 -16.1 59.5 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.285 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -67.93 156.98 36.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.018 0.437 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.408 ' HG2' HG21 ' A' ' 112' ' ' THR . 63.3 mttt -73.56 141.68 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.366 178.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 162' ' ' ILE . 97.4 t -91.82 113.64 27.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.358 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -78.43 154.79 30.34 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.337 0.589 . . . . 0.0 111.57 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 48.0 t -69.96 122.16 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.322 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.26 -11.55 36.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.07 127.71 33.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.891 0.376 . . . . 0.0 110.935 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.439 ' HA ' ' O ' ' A' ' 212' ' ' TRP . 6.8 m-20 -69.82 114.02 7.61 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 175' ' ' VAL . 70.1 mt -99.78 149.5 23.29 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.481 HD13 ' NE2' ' A' ' 209' ' ' GLN . 57.9 mt -114.3 112.3 39.56 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -92.24 138.12 31.79 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.063 0.459 . . . . 0.0 112.048 -178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.474 HG22 ' CD1' ' A' ' 191' ' ' TYR . 80.0 t -130.48 127.99 63.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.709 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.8 m -64.59 123.16 18.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.469 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.2 t -67.44 -30.26 48.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.832 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.9 t -79.13 -38.38 36.22 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.461 ' HB2' HH11 ' A' ' 190' ' ' ARG . 94.2 p -120.52 10.61 11.17 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 45.29 33.07 1.12 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.491 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 39.1 mtt85 -109.01 138.39 45.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.961 0.41 . . . . 0.0 110.884 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.5 m-85 -72.2 153.06 41.83 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.404 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.4 tp -75.28 75.5 2.4 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 175.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -74.15 151.12 40.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -174.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.535 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.2 tp -101.53 115.8 31.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.721 -1.582 . . . . 0.0 107.645 177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 45.4 p -109.28 145.83 35.3 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -105.7 92.45 4.18 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.73 -174.3 46.39 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.266 -0.968 . . . . 0.0 111.368 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 39.6 m-80 -1.14 -78.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.298 0.639 . . . . 0.0 112.52 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 86.6 p -146.68 12.87 1.16 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.07 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 49.9 m -126.74 -178.45 4.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.953 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.613 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.0 m95 -108.53 135.47 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.281 0.563 . . . . 0.0 111.328 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.471 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 22.8 m-70 -127.66 175.33 8.37 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.064 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.23 133.69 63.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.443 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -150.7 172.15 16.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.605 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -98.77 95.99 7.59 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.449 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.93 179.18 4.02 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.045 -0.525 . . . . 0.0 112.325 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -87.21 8.16 25.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.835 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.456 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 37.2 mt-30 -114.16 134.98 54.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.721 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.481 ' NE2' HD13 ' A' ' 182' ' ' ILE . 90.4 mt-30 -64.05 174.32 1.58 Allowed 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 122.296 1.046 . . . . 0.0 112.742 -178.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 193' ' ' HIS . 28.2 m -167.85 121.6 0.94 Allowed 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 113.102 -1.863 . . . . 0.0 107.912 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.422 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 41.1 mt -76.37 130.31 37.88 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.122 0.487 . . . . 0.0 109.885 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.439 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 99.1 m95 -117.54 147.58 42.66 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.705 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 46.7 t -114.02 99.19 7.46 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.377 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.746 HG22 ' HG ' ' A' ' 22' ' ' LEU . 94.8 t -91.85 100.78 11.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.759 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -114.83 140.69 25.76 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.092 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 19' ' ' GLU . 27.9 Cg_exo -62.1 104.69 0.35 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.079 1.853 . . . . 0.0 111.251 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.557 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 3.8 mm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.235 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.875 0.369 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -120.84 158.12 28.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.242 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.7 mt -81.96 120.5 25.31 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.494 HH21 ' H ' ' A' ' 109' ' ' GLY . 7.8 mmm180 -109.12 158.65 17.58 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.99 0.424 . . . . 0.0 111.035 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.5 p -67.75 157.22 35.19 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.793 179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 69.03 -2.31 1.82 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.877 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -74.25 134.36 42.66 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.468 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -79.68 119.37 22.52 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.533 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.9 m -136.88 169.64 19.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.663 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -132.22 140.28 48.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 108.398 176.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.769 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.22 122.01 42.37 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.691 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.573 HE22 ' HB3' ' A' ' 57' ' ' ASN . 42.9 mt-30 -122.15 151.77 40.62 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.527 0.679 . . . . 0.0 111.889 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.1 p -137.57 140.8 41.23 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.808 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -83.26 122.82 28.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.157 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.622 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.81 120.96 40.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.4 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.3 m -125.66 140.15 52.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.428 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.1 tt -175.71 143.13 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.642 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.1 m80 58.09 39.23 26.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.749 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 62.25 26.22 15.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.049 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -129.26 122.84 30.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.575 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -116.02 149.15 39.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.1 pt20 -161.16 174.15 14.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.67 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.402 ' HE3' ' HB3' ' A' ' 23' ' ' GLN . 18.5 mtpp -120.98 135.19 55.27 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.504 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.2 mt -125.18 142.33 51.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.568 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 43.8 t -106.44 142.97 35.23 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.894 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD21 HD13 ' A' ' 130' ' ' LEU . 27.0 tp -63.49 115.61 4.81 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.795 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.19 164.69 14.11 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.683 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.82 165.47 9.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.683 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.93 144.64 39.15 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.627 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -82.26 17.55 17.83 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.662 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -126.75 151.95 47.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.809 0.338 . . . . 0.0 110.446 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.15 -135.86 15.26 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.262 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.502 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -85.56 8.12 20.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.706 0.289 . . . . 0.0 110.78 179.649 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 44.0 29.23 0.31 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.922 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.502 ' H ' HD22 ' A' ' 44' ' ' ASN . 42.9 mt -78.11 142.25 38.21 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 120.974 0.416 . . . . 0.0 110.55 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.62 151.4 25.34 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.512 0.672 . . . . 0.0 111.098 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 64' ' ' ILE . 21.9 p90 -144.9 -167.58 2.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.763 -1.108 . . . . 0.0 108.555 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 23.0 mt -131.36 142.6 50.1 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.402 -0.519 . . . . 0.0 112.305 -178.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 48.1 mt-10 -106.19 134.61 49.06 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.158 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.563 ' HA ' HD23 ' A' ' 35' ' ' LEU . 59.2 m -78.92 125.73 29.76 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 176.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.571 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 57.8 p -94.68 157.93 15.74 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 120.034 -0.666 . . . . 0.0 111.24 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.0 m -67.1 -9.43 39.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.548 -179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.45 ' HA ' HD22 ' A' ' 57' ' ' ASN . 85.1 m-20 59.93 14.29 4.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.941 0.4 . . . . 0.0 110.825 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 66.1 p -154.04 76.05 1.04 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.873 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 24.8 ttmm -109.09 94.2 4.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.957 0.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.573 ' HB3' HE22 ' A' ' 23' ' ' GLN . 14.8 m120 55.95 22.03 5.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.313 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 30.2 t -63.8 107.91 1.55 Allowed Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 11.9 Cg_exo -73.89 141.36 30.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.104 2.536 . . . . 0.0 111.106 177.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.81 -37.48 35.95 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.497 2.131 . . . . 0.0 111.654 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -135.3 93.73 3.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.535 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.504 HD11 HG11 ' A' ' 21' ' ' VAL . 50.5 tp -66.28 -34.12 77.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.13 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.463 ' HG ' ' HD1' ' A' ' 125' ' ' TYR . 8.4 t -50.07 -51.09 45.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.744 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.408 HD12 ' CZ ' ' A' ' 48' ' ' PHE . 33.2 pt -72.05 -15.97 18.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.887 0.375 . . . . 0.0 111.593 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.663 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.97 -1.52 45.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.339 0.59 . . . . 0.0 110.307 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.494 HG22 ' OG ' ' A' ' 124' ' ' SER . 34.0 m -85.92 135.65 33.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.022 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -139.16 161.88 36.32 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.866 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -125.73 132.88 70.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.65 178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.419 HD23 ' CD2' ' A' ' 121' ' ' LEU . 15.4 mt -82.01 66.93 7.8 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.2 mm-40 -46.28 -62.5 1.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.405 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 9.2 mm100 -121.67 165.72 15.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.667 0.746 . . . . 0.0 112.963 -177.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -158.93 82.72 0.79 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.9 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -111.37 156.55 21.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.413 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.0 t -69.77 147.15 50.83 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.22 -45.33 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.101 0.477 . . . . 0.0 110.254 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.3 ttp85 -55.5 -54.72 40.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.295 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.41 -45.17 94.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.015 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.0 tp -59.93 -46.54 89.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.394 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.99 -34.78 78.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.928 0.394 . . . . 0.0 110.772 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.77 -41.45 87.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.865 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.3 mtt -63.43 -44.05 95.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -69.66 -34.39 73.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.881 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.73 75.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -72.78 -25.35 61.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.331 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 73.0 p -81.66 0.87 36.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 111.207 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.9 t -82.85 -27.87 8.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.985 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -116.11 -70.66 0.78 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.046 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -165.16 144.87 6.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.064 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 65.0 m -146.4 -81.65 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.021 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 59.29 105.27 0.02 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.289 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 115.87 35.55 1.24 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.446 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.13 -15.45 59.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.847 0.355 . . . . 0.0 111.006 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -74.93 -168.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.406 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.581 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 5.3 m-20 -55.49 109.68 0.59 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.003 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.37 -15.42 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.033 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.77 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 12.6 mm-40 -53.88 -45.37 71.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 118.861 -0.59 . . . . 0.0 112.224 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 20.7 ptmt -86.55 -44.15 12.15 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.971 1.308 . . . . 0.0 110.826 -3.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -53.35 -49.42 67.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.219 -1.355 . . . . 0.0 112.731 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.527 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 55.3 mtpt -55.48 -30.59 60.87 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.667 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.77 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.2 t80 -73.81 -48.23 32.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.026 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.09 -42.51 85.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.863 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.11 -39.43 72.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.653 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -60.61 -39.91 89.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.542 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.6 m -72.39 -49.16 35.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.256 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.98 78.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.495 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -79.88 -28.7 39.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.015 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -66.91 -34.89 88.53 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -169.95 -176.03 39.34 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.452 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.494 ' H ' HH21 ' A' ' 15' ' ' ARG . . . -142.09 72.88 0.38 Allowed Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.73 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 -87.16 -31.53 20.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 117.575 0.687 . . . . 0.0 111.048 -0.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -166.93 143.28 4.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.022 0.439 . . . . 0.0 111.462 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 89.5 m -75.81 148.38 38.46 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.027 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mp -81.74 129.58 34.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.589 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 79.1 mt -114.92 143.13 45.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.252 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -62.57 133.23 54.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.024 0.44 . . . . 0.0 110.471 179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.7 -11.64 64.59 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.048 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.441 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -84.09 139.74 32.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.982 0.42 . . . . 0.0 111.356 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.42 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.26 128.71 34.1 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.8 pt -113.39 159.22 13.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 121.547 0.689 . . . . 0.0 112.792 -178.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.405 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.0 tp -115.4 108.39 16.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.7 -1.137 . . . . 0.0 109.858 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.419 ' CD2' HD23 ' A' ' 69' ' ' LEU . 48.3 mt -95.76 118.11 31.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.665 -179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 19.7 ttp180 -103.75 115.36 30.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.669 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.494 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.1 t-80 -57.44 109.5 0.7 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.494 ' OG ' HG22 ' A' ' 66' ' ' THR . 52.9 m -52.75 -48.81 66.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.494 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 77.4 t80 -61.6 -62.5 1.76 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.443 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.7 p -73.26 -20.74 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -178.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.81 -1.23 74.46 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.084 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.3 mtt -83.37 -165.92 1.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.504 -0.184 . . . . 0.0 110.504 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.467 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 60.0 m-85 -133.03 139.06 47.02 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.479 HD13 HD21 ' A' ' 37' ' ' LEU . 24.2 tp -54.42 129.53 36.11 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.4 t -138.81 147.32 42.39 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.6 t -94.04 98.05 10.74 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.0 mt -73.74 156.83 37.46 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.559 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 55.0 m -81.61 -10.38 59.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.432 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -87.13 123.75 32.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.711 0.291 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 57.9 m -71.0 -60.38 2.26 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.961 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.513 ' HG3' ' H ' ' A' ' 138' ' ' SER . 10.7 ptm180 -176.11 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.157 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.513 ' H ' ' HG3' ' A' ' 137' ' ' ARG . 57.8 p -175.32 -66.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.047 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.4 m -75.42 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.063 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.7 p -72.13 169.48 15.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.214 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.436 ' HA ' ' OG ' ' A' ' 136' ' ' SER . 4.4 p30 -167.72 25.38 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -143.02 -41.33 0.31 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.754 -179.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 143' ' ' LEU . 3.8 mm? -60.2 -89.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -109.09 149.85 28.69 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.326 0.584 . . . . 0.0 111.759 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 15.7 m-85 -103.17 169.43 8.56 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.928 178.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -88.26 144.09 26.64 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 99.1 t -113.51 116.09 51.61 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.463 178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.72 -147.89 5.76 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.323 -0.941 . . . . 0.0 112.695 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 70.2 mt -116.3 153.49 31.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.828 0.346 . . . . 0.0 110.618 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -143.62 139.21 29.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.81 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.96 -69.24 0.36 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.473 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.75 143.77 51.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.589 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.401 HG21 HD21 ' A' ' 120' ' ' LEU . 52.3 p -103.15 1.32 33.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.349 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.0 p -56.23 115.12 2.27 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 124.56 -161.89 18.9 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.613 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.487 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 33.8 mt-10 -117.07 -11.25 10.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.815 0.341 . . . . 0.0 111.273 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.44 -32.71 67.19 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 83.8 m -92.22 9.45 33.68 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -111.22 132.5 54.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.099 0.476 . . . . 0.0 111.361 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.4 m95 -127.45 117.15 21.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.597 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 7.4 p -79.06 128.14 32.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.267 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.528 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -89.48 133.41 31.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.955 0.407 . . . . 0.0 111.052 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.464 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.5 m80 -126.57 150.15 69.99 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.2 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.702 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.3 Cg_endo -67.54 137.52 42.92 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.519 2.146 . . . . 0.0 112.065 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.29 -43.42 56.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.688 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 54.9 m -106.88 -174.04 2.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.039 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.63 8.06 40.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.157 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -83.83 -34.67 24.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.853 -179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.702 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 72.3 mmt-85 -90.02 148.23 23.19 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.531 178.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 51.1 m -128.13 167.15 17.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.953 0.406 . . . . 0.0 111.356 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -65.98 135.76 55.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 89.29 -16.88 54.85 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.395 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 23.8 mt-10 -67.41 154.97 40.13 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.924 0.393 . . . . 0.0 111.161 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 69.3 mttt -71.87 142.15 49.56 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 178.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.528 HG21 HD12 ' A' ' 162' ' ' ILE . 92.5 t -91.53 113.03 26.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.755 0.312 . . . . 0.0 110.412 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -75.51 152.96 37.75 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.34 0.591 . . . . 0.0 111.5 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.444 HG13 ' HD3' ' A' ' 216' ' ' PRO . 25.6 t -68.94 121.43 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 176.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.69 -11.9 35.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.342 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.36 130.34 42.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.831 0.348 . . . . 0.0 110.905 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 13.2 m-20 -71.95 112.18 7.82 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 76.5 mt -98.13 150.07 21.84 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.464 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.4 mt -114.32 112.89 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.1 mp -92.75 136.28 33.38 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.191 0.52 . . . . 0.0 112.129 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.453 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.7 t -128.74 126.27 64.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.862 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 5.3 m -63.93 125.47 24.52 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -70.63 -32.05 48.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.682 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.7 t -81.21 -36.31 30.23 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 53.1 m -114.98 5.51 15.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -177.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 45.22 33.16 1.1 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -116.09 142.47 46.76 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.989 0.424 . . . . 0.0 110.772 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.8 m-85 -72.6 153.84 41.06 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 27.3 tp -75.31 76.45 2.41 Favored 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 175.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.6 t60 -75.54 150.74 38.05 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -174.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -101.59 114.39 28.39 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.705 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.419 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 48.2 t -107.88 146.24 32.6 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -177.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -106.41 91.2 3.6 Favored 'General case' 0 N--CA 1.443 -0.795 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.02 -179.73 52.98 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.236 -0.983 . . . . 0.0 111.032 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 35.1 m-80 7.65 -83.7 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.23 0.612 . . . . 0.0 112.386 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 49.7 m -142.19 5.71 1.69 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.349 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.1 m -120.89 -179.31 3.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.206 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.622 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.6 m95 -106.27 139.3 40.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.274 0.559 . . . . 0.0 111.198 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.439 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 32.4 m-70 -130.26 172.08 12.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.962 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.88 132.6 69.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.295 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.419 ' OD2' ' HB2' ' A' ' 195' ' ' SER . 2.8 p30 -150.31 170.19 19.6 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.588 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.491 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.49 93.77 6.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.307 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -113.07 175.8 5.29 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.268 -177.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -84.02 10.66 9.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.195 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.417 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 14.0 mm100 -117.6 136.5 53.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.684 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' A' ' 209' ' ' GLN . 21.3 mt-30 -64.56 175.61 1.35 Allowed 'General case' 0 CA--C 1.509 -0.601 0 CA-C-O 122.434 1.111 . . . . 0.0 113.151 -178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 23.7 m -169.49 120.07 0.68 Allowed 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 112.919 -1.946 . . . . 0.0 107.721 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 31.6 mt -74.76 128.91 36.71 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.923 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.35 144.88 43.1 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.566 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.9 t -112.44 101.18 9.37 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.428 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.769 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.6 t -92.68 100.48 11.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.779 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -111.46 142.15 25.92 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.186 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.446 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.1 Cg_exo -63.68 103.73 0.41 Allowed 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.209 1.939 . . . . 0.0 111.365 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.533 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.9 mm . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.926 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -120.35 153.61 36.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.54 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.6 mt -80.73 122.59 27.33 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.4 mmm180 -109.75 157.29 19.29 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 111.182 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.409 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.1 p -67.82 156.45 37.07 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.763 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.74 -9.9 1.03 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.69 -179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.9 m-20 -67.72 134.09 50.45 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -79.8 120.41 24.03 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.471 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.7 m -136.35 172.99 14.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.675 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -135.16 139.23 47.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.479 -1.237 . . . . 0.0 108.304 176.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.779 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.2 mp -100.04 122.62 43.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.529 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.453 HE22 ' HE2' ' A' ' 34' ' ' LYS . 18.5 mt-30 -123.04 146.02 48.03 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.625 0.726 . . . . 0.0 112.223 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.0 p -131.38 142.56 50.07 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.752 178.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.7 m -84.25 120.95 26.83 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.322 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.588 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.99 117.51 31.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.216 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 23.1 m -122.02 137.02 54.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.023 0.44 . . . . 0.0 111.731 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -171.89 144.8 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.496 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 42.3 m80 60.19 34.84 21.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.62 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt 64.19 25.43 13.63 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.133 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -128.37 126.66 41.11 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.177 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -116.26 141.86 47.59 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 111.571 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -151.59 174.39 13.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.633 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.523 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 27.7 mtmm -122.28 135.54 54.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.645 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.7 mt -124.62 141.58 51.99 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.523 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 42.3 t -104.76 142.34 34.89 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.684 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.49 ' HA ' HD23 ' A' ' 49' ' ' LEU . 35.7 tp -60.93 112.93 2.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.684 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.426 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.73 163.4 14.19 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.515 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.73 160.21 10.39 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.405 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.7 141.85 48.78 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.622 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.414 ' HA2' ' CE ' ' A' ' 128' ' ' MET . . . -81.82 16.36 21.11 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.193 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -122.13 148.52 44.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 0.0 110.714 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.58 -138.39 20.24 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.583 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -81.54 8.83 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.644 0.259 . . . . 0.0 110.971 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 42.08 31.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.249 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.9 mt -78.31 138.65 38.69 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.974 0.416 . . . . 0.0 110.556 179.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.3 m -79.86 151.47 30.19 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.631 0.729 . . . . 0.0 111.413 -179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.9 p90 -146.71 -161.9 1.42 Allowed 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.558 -1.201 . . . . 0.0 108.348 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 21.5 mt -132.89 145.36 50.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.0 112.066 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.4 tt0 -112.69 139.36 48.36 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.526 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.46 ' HA ' HD23 ' A' ' 35' ' ' LEU . 39.5 t -78.92 144.06 35.24 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.461 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 61.6 p -104.89 153.99 20.65 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.908 0.385 . . . . 0.0 110.488 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.479 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 29.1 t -51.7 -19.36 1.56 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.605 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.8 t30 66.44 150.45 0.05 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.175 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 66.8 m 53.55 70.36 0.6 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.989 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.453 ' N ' ' HD3' ' A' ' 56' ' ' LYS . 4.0 mppt? -82.12 -51.23 8.18 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 122.805 0.442 . . . . 0.0 111.097 -0.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.523 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -162.96 -96.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.052 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.0 t 61.36 101.33 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HG3' HG22 ' A' ' 52' ' ' THR . 11.0 Cg_exo -72.18 139.1 31.81 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 123.109 2.539 . . . . 0.0 111.457 178.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.423 ' HD2' ' O ' ' A' ' 51' ' ' SER . 10.1 Cg_endo -51.85 -37.59 66.44 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.288 1.992 . . . . 0.0 111.451 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -122.84 84.82 2.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.783 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.623 HD11 HG11 ' A' ' 21' ' ' VAL . 44.8 tp -65.74 -30.44 71.1 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.3 p -46.83 -51.87 15.56 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.426 HD12 ' HB1' ' A' ' 38' ' ' ALA . 32.1 pt -71.38 -17.32 19.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.675 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -98.19 -1.33 42.35 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.937 0.399 . . . . 0.0 111.452 -179.233 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.487 HG22 ' OG ' ' A' ' 124' ' ' SER . 27.1 m -84.66 132.9 34.42 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -179.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -137.07 162.91 32.05 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.971 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 t -126.27 133.92 67.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 HG11 ' A' ' 20' ' ' VAL . 18.4 mt -82.64 66.55 8.3 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.483 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.7 mm-40 -45.5 -64.62 0.69 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.453 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.1 mm100 -122.98 165.26 17.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.773 0.797 . . . . 0.0 113.033 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 74.8 m -156.11 86.12 1.03 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.114 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.5 mt -112.96 157.09 21.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.514 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.7 t -69.65 146.86 51.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 57.9 t -50.36 -45.73 25.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.12 0.486 . . . . 0.0 110.236 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.8 ttp85 -57.18 -51.57 68.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.218 179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -62.19 -44.63 96.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.789 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.72 -46.75 89.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.263 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -67.29 -33.6 75.64 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.925 0.393 . . . . 0.0 110.569 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.21 -41.99 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.551 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.9 mtt -64.72 -42.44 95.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.69 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.36 -32.68 71.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.656 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.29 -31.73 69.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.534 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -73.64 -17.19 61.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.244 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.6 p -92.45 -7.78 46.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.725 0.297 . . . . 0.0 111.417 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.1 t -72.39 -40.42 64.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.139 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -87.0 -174.38 4.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.773 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -60.37 -68.93 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.815 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 66.2 m 57.07 98.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.502 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -104.78 100.4 10.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.607 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.96 24.92 70.47 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.598 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -130.42 113.87 14.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.786 0.326 . . . . 0.0 110.758 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.2 p -157.63 -10.37 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.425 ' HB3' ' HG2' ' A' ' 96' ' ' GLU . 9.3 m-20 -112.03 93.02 4.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.609 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.7 p -77.3 2.73 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-O 121.156 0.503 . . . . 0.0 111.353 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.713 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.8 OUTLIER -52.26 -48.99 64.93 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.916 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.713 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 89.9 mttt -89.38 -57.61 2.82 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 123.068 1.414 . . . . 0.0 108.843 -5.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -77.8 -27.39 50.11 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 112.873 -1.967 . . . . 0.0 111.655 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -57.0 -59.2 5.41 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.249 -0.58 . . . . 0.0 111.068 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.555 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.5 t80 -77.33 -36.01 54.27 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.919 178.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 27.4 ttt -57.26 -38.53 74.01 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.082 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.5 ttt -76.64 -42.8 40.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -57.0 -42.43 80.26 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.844 0.354 . . . . 0.0 110.249 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 20.0 p -72.52 -44.37 62.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.655 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.35 -31.84 66.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -80.04 -48.91 12.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.83 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -166.58 67.36 0.19 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.671 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -66.01 -59.13 7.8 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -92.89 165.06 27.94 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.413 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 42.1 m-70 -83.46 176.21 9.23 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 117.553 0.676 . . . . 0.0 110.753 0.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -141.09 144.94 35.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.054 0.454 . . . . 0.0 111.625 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.3 m -77.45 147.35 35.99 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.17 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.42 130.84 35.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.695 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 84.2 mt -114.98 142.35 46.75 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.226 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -63.17 132.37 51.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.977 0.418 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.47 -15.64 59.79 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.979 -179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -80.51 141.63 34.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.102 0.477 . . . . 0.0 111.568 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -83.02 127.32 33.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.132 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.0 pt -112.01 162.82 9.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.492 0.663 . . . . 0.0 112.761 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.453 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 20.9 tp -118.73 109.99 16.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.949 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 54.7 mt -98.0 117.77 33.08 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.615 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.483 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.7 ttp-105 -104.08 116.15 31.7 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.643 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.438 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 29.2 t-80 -58.11 109.06 0.68 Allowed 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.487 ' OG ' HG22 ' A' ' 66' ' ' THR . 69.9 m -50.07 -54.13 22.43 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.438 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 46.7 t80 -57.54 -69.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.411 ' OG ' HD13 ' A' ' 149' ' ' LEU . 54.5 p -62.76 -29.39 70.66 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.73 -1.82 88.01 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.085 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . 0.414 ' CE ' ' HA2' ' A' ' 41' ' ' GLY . 64.1 mtm -85.29 -165.69 1.29 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.814 -0.193 . . . . 0.0 110.575 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.474 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 59.0 m-85 -132.27 140.07 48.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.463 HD13 HD21 ' A' ' 37' ' ' LEU . 24.7 tp -55.03 128.46 33.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 177.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 41.8 t -137.97 147.7 44.51 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -176.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -94.58 97.98 10.5 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.502 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.2 mt -74.71 155.45 37.69 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.341 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 38.1 t -85.72 3.97 38.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.928 -178.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 64.2 p -92.2 123.72 35.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.649 0.262 . . . . 0.0 110.977 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 54.8 m -64.13 -60.9 2.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.682 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.403 ' HG3' ' N ' ' A' ' 138' ' ' SER . 15.1 ptp180 179.66 -48.74 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.899 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.403 ' N ' ' HG3' ' A' ' 137' ' ' ARG . 48.1 t -164.53 -81.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.965 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -156.87 -1.25 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.134 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 30.6 m -63.22 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.314 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -111.11 -175.44 2.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.792 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -137.32 -5.7 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.079 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.473 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 3.6 mm? -60.24 -92.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.02 0.438 . . . . 0.0 110.843 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.408 ' HA ' ' O ' ' A' ' 205' ' ' ALA . . . -58.6 142.48 49.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.493 0.664 . . . . 0.0 112.236 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 18.8 m-85 -101.81 173.03 6.59 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.767 -1.106 . . . . 0.0 108.963 177.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -90.98 141.99 28.25 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.7 117.68 55.71 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.008 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.346 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.84 -150.66 6.13 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.769 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.448 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 72.3 mt -114.39 148.43 37.69 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.902 0.382 . . . . 0.0 110.618 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -135.22 141.58 45.83 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.891 -179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.39 -58.7 3.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.71 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -82.64 151.69 26.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.883 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 81.7 p -107.33 -3.19 19.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.162 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 67.8 p -56.71 113.02 1.46 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.14 -159.02 22.23 Favored Glycine 0 N--CA 1.442 -0.965 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.517 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.502 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 42.1 mt-10 -120.63 -12.54 8.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.781 0.324 . . . . 0.0 111.301 -179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.87 -32.24 67.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.214 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.0 m -92.17 9.1 35.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -111.69 131.45 55.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.147 0.498 . . . . 0.0 111.408 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.46 ' O ' HG12 ' A' ' 119' ' ' ILE . 53.8 m95 -126.47 117.52 23.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.775 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 11.9 p -79.07 126.4 30.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.101 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.466 HD12 HG21 ' A' ' 175' ' ' VAL . 3.1 pt -88.56 135.17 26.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.855 0.359 . . . . 0.0 111.009 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.486 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.6 m80 -127.25 151.58 74.8 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.149 -179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.5 Cg_endo -67.6 138.83 46.76 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.554 2.169 . . . . 0.0 112.275 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -76.72 -42.38 41.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.447 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 36.4 m -105.01 -173.09 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.416 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.402 ' HE2' ' HB2' ' A' ' 167' ' ' LYS . 0.0 OUTLIER -95.41 6.92 47.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.475 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -86.23 -34.26 20.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.947 0.403 . . . . 0.0 110.792 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 4.4 mmp_? -86.78 146.52 26.21 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 33.9 t -127.07 166.45 17.59 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.429 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.84 129.08 38.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.253 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.24 -13.61 64.44 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.999 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -71.8 158.47 36.03 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.943 0.401 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -74.09 143.16 45.51 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.466 HG21 HD12 ' A' ' 162' ' ' ILE . 89.8 t -93.48 114.93 31.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.264 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -80.74 155.0 26.93 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 121.325 0.583 . . . . 0.0 111.709 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 50.1 t -69.84 122.82 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.54 -18.0 27.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.922 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -66.88 128.79 37.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.753 0.311 . . . . 0.0 110.746 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.457 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.3 m-20 -72.99 116.54 13.62 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.429 HD21 HG13 ' A' ' 175' ' ' VAL . 61.7 mt -99.73 149.43 23.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.486 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 56.2 mt -114.31 112.85 41.9 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 176.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.71 137.61 32.21 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.177 0.513 . . . . 0.0 112.278 -178.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.443 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.7 t -130.41 124.21 56.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.841 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 32.2 t -63.06 127.46 31.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.794 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.502 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 97.7 t -71.39 -32.26 46.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 120.896 0.379 . . . . 0.0 110.814 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 96.1 p -78.91 -39.42 34.87 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.477 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 55.1 m -114.06 4.91 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.2 OUTLIER 47.32 31.15 1.7 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.473 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 0.3 OUTLIER -112.32 144.18 42.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.93 0.395 . . . . 0.0 110.69 179.868 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.474 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 60.8 m-85 -74.15 152.57 39.81 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -178.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' HG ' ' CZ2' ' A' ' 212' ' ' TRP . 41.3 tp -75.15 77.6 2.3 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 175.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -77.75 150.44 34.38 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -174.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.8 tp -100.1 119.16 37.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 113.673 -1.603 . . . . 0.0 107.532 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.3 t -113.01 147.19 37.69 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -106.55 90.17 3.25 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.09 -175.03 46.32 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.17 -1.014 . . . . 0.0 111.437 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 34.8 m-80 1.11 -78.55 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.368 0.667 . . . . 0.0 112.496 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 34.6 t -147.05 11.38 1.05 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 52.2 m -125.88 -178.97 4.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.982 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.588 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.2 135.6 48.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.21 0.528 . . . . 0.0 111.195 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.469 ' CD2' ' HA3' ' A' ' 197' ' ' GLY . 29.9 m-70 -127.23 174.73 8.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.79 130.07 66.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.283 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -147.05 172.31 13.93 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.606 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.26 92.31 5.38 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 178.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -110.61 179.64 4.02 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.562 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -88.11 11.38 16.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.298 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -119.6 137.65 53.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.697 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -64.31 175.58 1.28 Allowed 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 122.352 1.072 . . . . 0.0 112.997 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.8 m -169.36 119.84 0.69 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 112.976 -1.92 . . . . 0.0 107.794 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.457 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 39.6 mt -74.36 129.41 37.74 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.045 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.412 ' CZ2' ' HG ' ' A' ' 192' ' ' LEU . 97.9 m95 -116.04 146.77 41.9 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.449 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 43.9 t -115.02 101.89 9.44 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.318 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.779 HG22 ' HG ' ' A' ' 22' ' ' LEU . 61.9 t -93.49 101.58 12.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.975 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.0 143.23 29.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.098 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.7 Cg_exo -64.38 105.26 0.59 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.237 1.958 . . . . 0.0 111.366 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.471 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.94 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -119.17 157.36 28.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.504 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.8 mt -80.11 122.47 26.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 178.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.479 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.2 mmm180 -111.71 158.05 19.77 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.186 0.517 . . . . 0.0 111.315 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 7.7 p -68.06 155.79 38.79 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.7 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 16' ' ' THR . 7.5 m-20 71.18 -3.46 2.06 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.841 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.431 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.7 m-20 -72.74 138.35 46.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -84.74 119.39 25.22 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.5 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -135.83 170.54 18.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -177.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.564 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -131.66 135.91 58.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.827 -1.079 . . . . 0.0 108.267 176.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.777 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -97.04 123.06 40.67 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.519 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.477 ' OE1' ' HB2' ' A' ' 57' ' ' ASN . 38.2 mt-30 -120.2 164.83 15.63 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 121.275 0.56 . . . . 0.0 111.355 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -151.82 142.88 23.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.49 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.8 m -86.99 119.73 27.5 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.43 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.11 119.84 39.23 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.851 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 17.7 m -123.88 132.01 53.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 112.037 -179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.528 HG23 ' CD2' ' A' ' 29' ' ' HIS . 17.7 tt -168.9 148.94 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.446 179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.528 ' CD2' HG23 ' A' ' 28' ' ' ILE . 47.7 m-70 58.23 42.0 22.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.874 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 59.82 23.21 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.28 179.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -126.5 145.68 50.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.412 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -130.71 142.52 50.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.924 0.392 . . . . 0.0 111.2 -179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.492 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -153.9 171.55 18.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.853 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 34' ' ' LYS . 17.3 mtpp -120.39 138.18 53.9 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.419 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.5 mt -127.14 145.43 50.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.709 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.21 137.62 46.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.987 0.423 . . . . 0.0 110.549 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.555 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.4 tp -60.83 111.69 1.75 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.168 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.438 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -110.56 165.54 11.73 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.417 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -168.89 162.02 11.09 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.802 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.57 148.09 50.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.7 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.9 -0.57 89.77 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.737 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -112.22 158.02 20.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.841 0.353 . . . . 0.0 110.902 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.36 -136.15 16.18 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.464 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.435 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 1.2 p30 -87.12 7.86 26.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.695 0.283 . . . . 0.0 110.877 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.87 28.84 0.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.323 179.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.8 mt -79.41 141.13 37.13 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.56 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.2 m -80.93 150.04 29.15 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.476 0.655 . . . . 0.0 111.245 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -144.14 -168.72 2.95 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.743 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.555 HD23 ' HA ' ' A' ' 37' ' ' LEU . 22.7 mt -130.94 144.53 51.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.422 0.63 . . . . 0.0 112.361 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.483 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.2 mt-10 -109.12 138.44 45.47 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.819 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.567 ' HA ' HD23 ' A' ' 35' ' ' LEU . 49.7 m -81.73 134.93 35.5 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 176.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.557 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 62.0 p -105.82 165.06 11.45 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.629 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.8 m -73.47 -10.96 60.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.007 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.42 ' C ' ' H ' ' A' ' 57' ' ' ASN . 63.7 m-20 61.75 13.47 5.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.982 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 58.6 m -155.76 76.05 0.93 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.14 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 47.5 pttt -106.29 100.19 9.74 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.246 0.618 . . . . 0.0 110.774 -0.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.557 ' C ' ' HB ' ' A' ' 52' ' ' THR . 10.6 p30 44.8 24.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.9 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 94.4 t -64.4 108.5 1.97 Allowed Pre-proline 0 CA--C 1.534 0.35 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 5.0 Cg_exo -79.7 140.23 14.62 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.839 2.359 . . . . 0.0 111.193 177.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -49.22 -40.33 42.71 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.115 . . . . 0.0 111.397 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.419 ' O ' HG12 ' A' ' 64' ' ' ILE . 13.0 t70 -128.78 92.63 3.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.709 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.564 HD11 HG11 ' A' ' 21' ' ' VAL . 50.1 tp -70.19 -29.22 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.009 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 52.3 m -52.32 -46.52 66.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -70.92 -20.34 21.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 57.1 m -97.71 13.02 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.072 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.505 HG22 ' OG ' ' A' ' 124' ' ' SER . 25.8 m -91.36 130.37 37.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.15 0.5 . . . . 0.0 111.91 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.06 161.53 35.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.108 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -125.66 133.34 69.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.609 178.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD12 ' HB2' ' A' ' 18' ' ' ASP . 17.1 mt -81.49 65.5 6.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 10.8 mm-40 -44.55 -60.23 2.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -178.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.406 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 58.2 mm-40 -126.42 163.67 22.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.706 0.765 . . . . 0.0 112.839 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.6 t -155.43 84.06 1.05 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.476 -1.238 . . . . 0.0 108.999 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -111.73 152.65 27.52 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.33 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.4 t -65.4 148.55 51.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -50.44 -46.09 26.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.027 0.441 . . . . 0.0 110.288 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.6 ttp-105 -55.55 -57.56 11.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.129 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.35 -44.76 84.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.177 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.8 -50.88 72.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.104 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -62.31 -34.57 76.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.629 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -65.74 -43.53 88.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.851 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.1 mtt -60.71 -47.08 87.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.904 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' O ' HG23 ' A' ' 86' ' ' VAL . 60.0 mt -67.43 -34.9 78.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.981 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.95 75.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.12 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -69.91 -17.99 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.588 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 68.8 p -90.31 -13.69 34.7 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.716 0.293 . . . . 0.0 111.359 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 82' ' ' LEU . 19.9 t -78.32 -49.01 21.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.89 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -92.29 -179.36 5.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 56.67 -167.67 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.9 t -146.1 -15.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.968 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -140.01 179.17 6.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 111.98 -15.29 26.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.458 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 56.36 -169.2 0.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.91 0.386 . . . . 0.0 111.156 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.4 t -73.41 -26.95 22.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.957 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.457 ' HB3' ' HB3' ' A' ' 100' ' ' PHE . 10.8 m-20 -83.27 84.78 7.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.917 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.4 m -83.81 -2.53 6.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.782 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 31.8 mm-40 -54.23 -44.23 71.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 118.735 -0.65 . . . . 0.0 112.37 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.723 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 26.1 ttmt -86.64 -50.6 6.68 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.363 1.465 . . . . 0.0 111.487 -2.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 51.6 t-105 -54.86 -36.68 65.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 113.895 -1.502 . . . . 0.0 113.319 -177.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 88.0 tttt -65.75 -32.82 74.58 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.095 -0.642 . . . . 0.0 110.771 -178.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.782 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.4 t80 -74.1 -49.37 24.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.999 0.428 . . . . 0.0 109.885 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 53.7 ttp -61.06 -37.94 84.42 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.763 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttp -73.41 -40.19 64.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.983 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -61.34 -45.21 95.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.788 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 48.9 p -70.85 -45.27 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.292 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.88 -31.08 72.05 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.257 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -78.33 -60.54 2.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.973 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -145.63 57.06 0.52 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.72 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.98 -42.21 94.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.403 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -146.08 165.23 28.18 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.482 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -78.51 -177.96 5.57 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.547 0.673 . . . . 0.0 110.917 -0.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.41 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 19.2 ptp180 -149.45 149.56 30.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.047 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.479 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 75.0 m -78.45 147.02 34.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.286 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.0 131.55 35.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.679 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 75.2 mt -115.29 143.39 45.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.046 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -62.79 132.68 53.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.041 0.448 . . . . 0.0 110.554 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.91 -11.84 64.18 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.039 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.93 141.42 32.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.038 0.447 . . . . 0.0 111.267 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.87 127.42 33.48 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 49.0 pt -111.41 161.87 9.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.565 0.698 . . . . 0.0 112.692 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.406 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 24.0 tp -117.74 108.25 15.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.809 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 69' ' ' LEU . 54.7 mt -96.37 116.85 29.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.832 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.493 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 13.4 ttp-105 -102.94 116.26 32.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.671 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.2 t-80 -58.44 108.32 0.61 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.505 ' OG ' HG22 ' A' ' 66' ' ' THR . 58.6 m -49.71 -53.09 26.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -177.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.434 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 32.3 t80 -58.57 -69.7 0.18 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 54.8 p -64.99 -23.75 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 81.27 -1.92 83.5 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.309 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.2 mtt -81.56 -164.65 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.503 0.192 . . . . 0.0 110.644 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.445 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.9 m-85 -134.77 137.87 43.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.2 tp -53.04 129.2 29.99 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -138.26 147.6 43.85 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.7 t -94.98 96.45 9.29 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 177.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.498 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 15.6 mt -71.44 156.66 39.21 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.574 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 45.7 t -83.13 -7.31 59.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.189 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 72.5 p -88.63 121.14 30.69 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.854 0.359 . . . . 0.0 111.23 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.559 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 28.6 t -75.53 -60.31 2.37 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.617 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 55.55 89.89 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.126 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.6 p -162.74 -65.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.656 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.2 p -163.86 -69.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.405 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 9.1 t -87.97 -18.59 28.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.425 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 55.42 84.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.387 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -175.82 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.097 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -55.33 -85.32 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.421 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -100.26 149.52 23.5 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.528 0.68 . . . . 0.0 112.158 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 18.5 m-85 -100.01 171.01 8.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.04 177.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -89.37 144.05 26.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 76.6 t -113.4 117.07 54.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.0 -147.19 5.6 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.307 -0.949 . . . . 0.0 113.006 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 57.7 mt -117.34 147.74 42.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.94 0.4 . . . . 0.0 111.074 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -136.05 142.95 44.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.742 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -75.4 -55.77 5.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.783 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -81.43 145.82 30.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.846 0.355 . . . . 0.0 110.882 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.3 p -103.59 -8.04 20.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.994 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 69.0 p -55.09 109.95 0.6 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.408 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.65 -158.36 23.21 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.42 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -122.13 -13.39 8.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.704 0.288 . . . . 0.0 111.124 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.71 -32.13 67.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.094 -179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.9 m -91.96 8.3 38.16 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.43 132.39 54.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.106 0.479 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.74 117.89 22.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.63 -179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.434 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 16.0 p -78.99 125.8 29.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.172 178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.478 HD12 HG21 ' A' ' 175' ' ' VAL . 3.4 pt -87.83 136.45 23.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.851 0.357 . . . . 0.0 110.676 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.489 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.8 m80 -129.04 150.21 74.71 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.644 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 41.0 Cg_endo -67.17 138.72 48.14 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.205 . . . . 0.0 112.287 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.28 -41.23 66.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.773 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 63.1 m -112.82 -167.78 1.23 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.176 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -91.59 -13.35 32.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.903 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -63.03 -35.71 81.13 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.997 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.644 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 75.9 mmt-85 -91.31 143.87 26.19 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 56.0 m -124.82 166.4 16.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.414 . . . . 0.0 111.611 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.84 131.21 45.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.51 179.545 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.41 -14.88 64.27 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.082 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -68.77 154.71 41.48 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.947 0.403 . . . . 0.0 111.043 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -70.55 142.89 51.74 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.478 HG21 HD12 ' A' ' 162' ' ' ILE . 93.3 t -93.03 110.92 23.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.498 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 153.23 40.14 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-O 121.289 0.566 . . . . 0.0 111.363 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 16.5 t -69.66 120.88 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 176.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 110.25 -13.75 30.96 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.304 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -67.58 132.28 47.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.775 0.321 . . . . 0.0 111.001 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 9.1 m-20 -73.1 116.17 13.3 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.421 HD21 HG13 ' A' ' 175' ' ' VAL . 60.7 mt -101.43 148.83 24.71 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.676 0.751 . . . . 0.0 112.964 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.489 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 51.9 mt -113.53 113.81 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.87 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 176.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.459 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.2 mp -93.6 137.28 33.03 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.112 0.482 . . . . 0.0 112.224 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.438 HG22 ' CD1' ' A' ' 191' ' ' TYR . 69.5 t -130.52 125.37 58.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.463 -0.789 . . . . 0.0 110.793 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 40.6 t -63.88 125.62 24.99 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.853 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 98.6 t -70.14 -30.81 45.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.88 0.372 . . . . 0.0 110.711 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.2 t -81.6 -33.78 31.32 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 189' ' ' GLU . 69.9 m -120.77 10.16 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.498 ' OE2' ' HG3' ' A' ' 190' ' ' ARG . 0.0 OUTLIER 43.3 31.19 0.36 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 179.245 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.498 ' HG3' ' OE2' ' A' ' 189' ' ' GLU . 27.4 mtt85 -112.2 142.66 44.41 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.089 -178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.475 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 58.8 m-85 -73.76 152.41 40.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 36.9 tp -74.76 75.99 2.08 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.8 t60 -75.64 149.47 38.18 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -174.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.7 tp -99.54 116.46 31.73 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.753 -1.567 . . . . 0.0 107.768 177.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 51.7 p -110.05 146.26 35.67 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -177.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -105.68 92.67 4.28 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 177.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -80.82 -174.84 49.03 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.435 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 33.1 m-80 0.66 -79.37 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.283 0.633 . . . . 0.0 112.409 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 80.8 p -146.61 12.2 1.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.967 -0.56 . . . . 0.0 109.98 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.7 p -125.94 -179.45 4.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.871 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.1 m95 -106.85 136.45 46.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.18 0.514 . . . . 0.0 111.196 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.515 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 26.6 m-70 -128.66 173.01 10.68 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.009 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.02 136.43 60.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.231 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -154.0 172.24 17.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.572 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.476 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -99.15 95.2 6.93 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.095 178.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -113.72 -179.4 3.63 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.321 -177.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -88.67 8.59 27.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.178 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 47.2 mt-30 -116.02 138.19 51.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.769 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.413 HE21 ' HB2' ' A' ' 209' ' ' GLN . 21.5 mt-30 -66.62 175.63 2.26 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 122.319 1.057 . . . . 0.0 113.242 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.0 m -170.04 121.3 0.65 Allowed 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 112.954 -1.93 . . . . 0.0 107.67 178.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 46.2 mt -74.68 131.42 40.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.798 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.3 m95 -118.89 127.48 53.53 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.344 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 47.5 t -93.16 101.45 13.74 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.318 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.777 HG22 ' HG ' ' A' ' 22' ' ' LEU . 97.9 t -93.86 102.5 13.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.663 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -115.18 142.03 27.97 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.335 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.28 103.93 0.39 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.14 1.893 . . . . 0.0 111.098 178.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.5 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.3 mm . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.299 -179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.793 0.33 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -121.11 154.13 36.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.7 mt -79.95 122.91 27.29 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.5 mmm180 -110.67 157.23 19.94 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.105 0.479 . . . . 0.0 111.257 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 111' ' ' ARG . 7.4 p -67.64 157.19 35.07 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.828 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 69.16 -2.2 1.89 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.793 -179.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 5.0 m-20 -73.95 139.81 45.13 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.443 179.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 16.8 tt0 -84.0 118.13 23.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.463 HG11 HD11 ' A' ' 69' ' ' LEU . 17.3 m -135.52 169.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.659 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.5 m -131.96 141.0 46.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 108.388 176.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.755 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -100.76 120.82 40.66 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.571 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -122.19 148.58 44.77 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.698 0.761 . . . . 0.0 112.323 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.514 ' SG ' HD22 ' A' ' 194' ' ' LEU . 27.1 t -136.45 147.45 47.23 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.492 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.0 m -88.99 123.49 33.36 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.552 179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.665 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -114.42 120.86 41.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.094 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 25.2 m -126.51 133.32 51.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.01 0.433 . . . . 0.0 111.766 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.522 HG23 ' CD2' ' A' ' 29' ' ' HIS . 18.4 tt -170.4 148.59 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.499 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' HG23 ' A' ' 28' ' ' ILE . 48.4 m-70 58.4 40.26 24.42 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.908 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.05 22.16 12.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.594 179.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -126.21 145.75 50.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.456 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -131.12 149.02 52.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.905 0.383 . . . . 0.0 111.196 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -161.6 169.58 21.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -116.42 138.22 51.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.526 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 2.6 mt -128.06 139.44 52.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.705 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 48.0 t -104.61 142.63 34.31 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.632 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 49' ' ' LEU . 32.3 tp -62.27 114.85 3.71 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.751 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 64' ' ' ILE . . . -114.67 165.04 13.22 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.5 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.56 166.27 10.1 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.715 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.59 145.75 38.97 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.616 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.16 17.34 33.43 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.198 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -123.44 150.27 44.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.852 0.358 . . . . 0.0 110.621 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.18 -135.8 15.65 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.493 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -85.12 8.7 17.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.689 0.28 . . . . 0.0 111.083 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.465 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.52 29.24 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.293 179.63 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.4 ' H ' HD22 ' A' ' 44' ' ' ASN . 37.6 mt -77.26 139.33 39.81 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.019 0.438 . . . . 0.0 110.546 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.3 m -81.12 151.18 28.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.593 0.711 . . . . 0.0 111.119 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -144.85 -165.65 2.21 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.61 178.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.52 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 24.8 mt -130.64 140.7 50.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.386 0.613 . . . . 0.0 112.083 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.0 OUTLIER -107.2 140.91 39.33 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.59 179.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.481 ' HA ' HD23 ' A' ' 35' ' ' LEU . 78.9 p -81.27 138.91 35.7 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.504 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 54.6 p -102.66 169.96 8.31 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.451 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 16.0 m -56.89 -15.09 4.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 59.56 19.26 7.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.643 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.9 m -148.33 71.24 1.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.684 -0.235 . . . . 0.0 111.376 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -86.15 -27.2 24.74 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 122.91 0.484 . . . . 0.0 110.503 -0.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.504 ' C ' ' HB ' ' A' ' 52' ' ' THR . 1.5 p30 -149.77 -109.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.686 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.9 t 61.23 100.4 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.327 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.91 140.56 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 123.399 2.732 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.406 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.4 Cg_endo -50.89 -39.92 58.33 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.479 2.119 . . . . 0.0 111.307 179.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -119.35 81.71 1.76 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.602 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.631 HD11 HG11 ' A' ' 21' ' ' VAL . 45.5 tp -63.39 -30.32 71.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.408 -178.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.2 m -46.72 -55.76 7.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 38' ' ' ALA . 26.9 pt -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.659 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -96.48 -3.27 43.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 0.0 111.262 -179.363 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.8 m -83.72 134.55 34.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.271 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.87 164.85 27.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.02 133.64 65.62 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.817 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD11 HG11 ' A' ' 20' ' ' VAL . 14.7 mt -82.85 65.01 7.76 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.492 ' HG3' ' HE2' ' A' ' 129' ' ' TYR . 10.3 mm-40 -44.55 -59.66 2.35 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -178.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.416 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 59.5 mm-40 -125.93 164.19 21.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.682 0.753 . . . . 0.0 112.897 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.0 t -156.18 84.77 1.0 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.993 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 13.0 mt -111.84 157.92 20.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.457 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.1 t -71.64 147.87 47.09 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.6 t -49.55 -44.12 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.095 0.474 . . . . 0.0 110.247 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.8 ttp85 -58.83 -50.08 75.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.98 97.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.828 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.81 -44.19 96.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.157 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.14 -33.14 73.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.884 0.373 . . . . 0.0 110.462 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.13 -41.92 85.33 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.551 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.7 mtt -64.32 -44.16 92.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.007 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.04 -31.58 69.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.823 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.85 69.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.753 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -75.44 -21.3 58.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.564 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 67.4 p -83.33 -9.65 58.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.851 0.357 . . . . 0.0 111.116 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 t -76.82 -19.49 14.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.734 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -81.13 -69.82 0.58 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.005 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -162.11 -82.1 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.99 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 47.7 t -169.58 165.49 10.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.733 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -107.35 -69.07 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.757 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.29 13.88 55.31 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.692 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -117.95 25.61 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.783 0.325 . . . . 0.0 110.79 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -57.14 -60.73 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.006 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -120.46 81.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.765 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.41 -5.2 9.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.586 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.79 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 20.9 mm-40 -53.8 -41.54 67.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.816 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.759 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 32.3 mtmm -86.61 -51.11 6.35 Favored 'General case' 0 C--N 1.351 0.637 0 CA-C-N 120.251 1.387 . . . . 0.0 111.326 -2.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -55.87 -40.52 73.04 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 113.847 -1.524 . . . . 0.0 112.881 -178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 20.8 tptm -58.18 -34.42 70.33 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.198 -0.601 . . . . 0.0 110.206 -179.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.79 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 2.0 t80 -73.44 -44.73 57.53 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 15.9 tpt -57.77 -34.37 69.5 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.216 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.5 mtp -73.22 -49.86 25.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -59.84 -34.69 73.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.646 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.9 m -72.65 -46.86 51.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.913 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.67 71.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -87.96 -26.99 22.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.744 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.01 -33.9 56.53 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.363 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -159.42 117.42 0.77 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.448 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.428 ' HA2' ' HA ' ' A' ' 110' ' ' HIS . . . 148.2 104.42 0.34 Allowed Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.444 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.428 ' HA ' ' HA2' ' A' ' 109' ' ' GLY . 26.7 m80 -76.39 -174.33 2.82 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 117.977 0.889 . . . . 0.0 110.957 0.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.429 ' HG2' ' OG1' ' A' ' 16' ' ' THR . 13.3 ptp180 -137.79 139.48 40.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 174' ' ' LYS . 88.8 m -70.8 148.16 48.17 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.094 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 mp -82.19 131.33 35.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.514 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 74.5 mt -116.37 141.85 47.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.387 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -61.36 131.86 51.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.495 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.21 -10.37 61.62 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.178 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -85.83 140.24 30.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.072 0.463 . . . . 0.0 111.365 -179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.88 127.53 33.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.3 pt -111.91 161.77 10.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.521 0.677 . . . . 0.0 112.732 -178.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.416 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 22.7 tp -117.49 109.31 16.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.885 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.404 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.2 mt -96.67 118.11 32.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.768 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.467 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 14.6 ttp-105 -104.28 116.46 32.19 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.454 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.453 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.8 t-80 -58.82 107.44 0.52 Allowed 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.3 t -49.79 -49.95 46.63 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -177.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 51.8 t80 -61.09 -67.25 0.42 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.423 ' OG ' HD13 ' A' ' 149' ' ' LEU . 56.0 p -68.22 -20.38 64.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 77.97 -0.85 71.02 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.252 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 54.5 mtt -82.67 -164.62 0.88 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 61.8 m-85 -133.95 138.26 45.36 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 37' ' ' LEU . 25.6 tp -54.05 127.89 28.36 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 177.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 51.8 t -136.69 149.86 48.14 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.1 t -97.52 99.09 10.48 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.536 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 11.8 mt -75.9 153.5 36.66 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 54.4 m -84.01 9.95 11.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.954 -178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.2 p -94.03 124.81 38.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 79.0 p -61.87 -60.29 3.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -170.78 -76.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.9 p -172.78 -13.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.1 m -125.96 -173.2 2.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.863 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 62.8 m -58.95 104.68 0.25 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.077 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -164.4 157.72 17.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.984 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -154.47 -9.68 0.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.808 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.47 -81.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.357 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -94.96 149.94 20.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.386 0.612 . . . . 0.0 112.071 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.536 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 14.0 m-85 -100.17 170.38 8.5 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.276 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -89.26 144.3 26.2 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -113.63 117.6 55.9 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.348 178.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.5 -147.08 5.52 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.899 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 59.0 mt -117.42 151.28 37.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.893 0.378 . . . . 0.0 110.774 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -141.69 142.97 33.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.886 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -74.54 -64.11 1.1 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.566 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -73.46 145.11 45.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.664 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 60.2 p -104.05 -5.13 22.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.947 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 70.3 p -54.71 111.84 0.9 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.527 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 129.84 -160.56 22.84 Favored Glycine 0 N--CA 1.441 -0.975 0 C-N-CA 120.663 -0.78 . . . . 0.0 111.485 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.432 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 35.9 mt-10 -118.53 -12.29 9.81 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.803 0.335 . . . . 0.0 111.234 -179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.91 -31.49 66.82 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 77.9 m -94.55 10.86 33.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -111.8 131.64 55.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.06 0.457 . . . . 0.0 111.57 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.482 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.0 m95 -127.22 116.64 20.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.662 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 8.0 p -79.25 128.6 33.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.188 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.492 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.81 135.59 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 0.0 110.842 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 68.0 m80 -127.8 150.23 72.74 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.186 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.715 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.3 Cg_endo -66.91 137.08 43.72 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.504 2.136 . . . . 0.0 112.297 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.01 -45.79 59.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.752 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.432 ' HB2' ' NE2' ' A' ' 168' ' ' GLN . 85.3 p -108.53 -175.59 2.82 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.262 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.74 14.83 14.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.139 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.432 ' NE2' ' HB2' ' A' ' 166' ' ' SER . 2.6 mp0 -88.21 -33.06 18.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.228 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.715 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.4 mmp_? -92.46 146.76 23.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.069 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 173' ' ' GLU . 32.0 t -125.1 165.76 17.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.278 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.8 OUTLIER -65.83 131.63 46.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.488 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . 0.402 ' O ' HD22 ' A' ' 114' ' ' LEU . . . 93.95 -16.43 60.91 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.049 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 170' ' ' SER . 21.1 mt-10 -67.49 155.08 39.92 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 121.042 0.448 . . . . 0.0 111.205 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 112' ' ' THR . 73.8 mttt -71.16 142.68 50.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.602 178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.492 HG21 HD12 ' A' ' 162' ' ' ILE . 95.4 t -93.74 112.0 25.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.148 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.441 ' HD2' ' N ' ' A' ' 176' ' ' ARG . 1.2 mpt_? -78.58 154.83 30.01 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-O 121.388 0.614 . . . . 0.0 111.611 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 55.2 t -69.05 122.72 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 176.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.25 -12.69 36.93 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.076 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.26 126.29 29.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.787 0.327 . . . . 0.0 110.796 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.449 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 18.9 m-20 -69.49 114.77 8.03 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.476 HD21 HG13 ' A' ' 175' ' ' VAL . 60.4 mt -100.44 151.84 21.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.788 0.804 . . . . 0.0 112.998 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.465 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 57.2 mt -115.75 113.74 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . . . . . . . . . 9.8 mp -93.48 135.32 34.84 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.201 0.525 . . . . 0.0 112.189 -178.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.459 HG22 ' CD1' ' A' ' 191' ' ' TYR . 73.1 t -127.35 126.66 68.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.739 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 42.4 t -67.03 124.18 22.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.432 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 98.4 t -68.64 -32.72 56.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.946 0.403 . . . . 0.0 110.968 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 47.2 t -78.0 -37.62 46.77 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 p -117.63 7.76 12.67 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 46.34 31.95 1.4 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.49 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 36.1 mtt85 -112.42 142.3 45.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.842 0.353 . . . . 0.0 110.884 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 63.6 m-85 -74.31 154.04 39.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.411 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 30.4 tp -76.09 76.95 2.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 105.404 -2.072 . . . . 0.0 105.404 175.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.403 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.3 t60 -76.89 150.23 36.03 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -174.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.514 HD22 ' SG ' ' A' ' 24' ' ' CYS . 13.4 tp -99.84 115.88 30.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 113.763 -1.562 . . . . 0.0 107.656 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 68.3 m -109.65 145.66 36.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -103.4 96.98 7.11 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 177.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.544 ' HA3' ' NE2' ' A' ' 202' ' ' HIS . . . -76.73 -167.03 25.67 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.04 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.461 ' C ' ' O ' ' A' ' 197' ' ' GLY . 4.4 p-10 -18.92 -63.03 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . 0.446 ' H ' ' ND2' ' A' ' 198' ' ' ASN . 86.3 p -154.7 11.59 0.37 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.217 0.532 . . . . 0.0 109.612 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 33.1 t -127.04 179.02 5.62 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.832 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.665 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.5 m95 -106.24 135.76 47.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.297 0.57 . . . . 0.0 111.27 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.544 ' NE2' ' HA3' ' A' ' 197' ' ' GLY . 15.1 m-70 -128.45 174.02 9.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.863 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 4.7 p -128.14 132.43 68.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.308 179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 48.2 p-10 -149.82 168.0 24.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.662 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.498 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.7 96.79 9.63 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -114.75 179.45 3.95 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.386 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -87.2 8.41 24.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.186 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.403 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 16.5 mm-40 -117.23 136.68 52.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.724 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.405 HE21 ' HB2' ' A' ' 209' ' ' GLN . 17.8 mt-30 -65.23 174.7 1.94 Allowed 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 122.364 1.078 . . . . 0.0 113.007 -178.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.7 m -166.71 121.54 1.11 Allowed 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 112.99 -1.914 . . . . 0.0 107.798 178.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 51.2 mt -75.23 128.74 36.14 Favored 'General case' 0 C--N 1.317 -0.804 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.035 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.411 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.2 m95 -116.27 145.32 43.24 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.611 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 39.2 t -113.04 101.29 9.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.278 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.755 HG22 ' HG ' ' A' ' 22' ' ' LEU . 92.5 t -92.61 102.19 13.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.918 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.24 142.36 27.89 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.475 ' O ' HG12 ' A' ' 217' ' ' ILE . 22.8 Cg_exo -64.8 105.26 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.252 1.968 . . . . 0.0 111.484 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.49 HG23 HD21 ' A' ' 62' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.833 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.829 0.347 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -122.7 153.05 39.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.653 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 31.4 mt -78.55 124.35 28.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -112.1 157.47 20.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.07 0.462 . . . . 0.0 110.952 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.2 p -67.64 155.38 39.31 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.863 179.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 71.02 -3.36 2.05 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.874 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -72.58 134.7 45.32 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.51 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -80.58 119.39 23.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.574 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 19.6 m -136.18 171.14 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.625 0.726 . . . . 0.0 112.948 -177.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.691 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.8 m -133.73 137.15 53.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.271 176.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.767 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.1 mp -97.73 121.77 40.04 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.613 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.62 ' NE2' HG21 ' A' ' 52' ' ' THR . 80.3 mt-30 -121.34 156.0 33.54 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.352 0.596 . . . . 0.0 111.538 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.529 ' SG ' HD22 ' A' ' 194' ' ' LEU . 21.5 t -143.7 144.48 31.88 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.368 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.4 m -86.14 124.98 33.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.445 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.624 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -116.36 119.53 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.034 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 30.2 m -122.46 139.38 53.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.781 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 19.2 tt -178.38 144.55 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.671 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.1 m80 59.11 41.15 21.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.318 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.3 20.98 11.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.626 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -127.81 134.28 49.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.735 0.302 . . . . 0.0 110.672 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -124.02 146.22 48.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.056 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -156.21 171.62 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.857 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.1 mtmt -117.87 136.37 53.5 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.464 178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -126.07 143.02 51.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.44 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.612 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 50.9 t -107.64 142.67 37.24 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.649 178.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 49' ' ' LEU . 30.3 tp -62.35 114.51 3.53 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.72 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.422 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -114.48 164.28 14.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.434 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.02 166.79 10.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.686 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -138.23 151.26 47.5 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.687 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.12 -6.92 87.66 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.624 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -107.82 163.07 13.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.11 -142.03 25.82 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.401 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 22.2 p30 -84.09 9.68 11.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 110.622 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.443 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.61 29.28 0.4 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.949 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 33.4 mt -79.37 139.17 37.82 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.97 0.414 . . . . 0.0 110.621 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 79.6 m -80.25 149.84 30.25 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.545 0.688 . . . . 0.0 111.131 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -144.17 -166.97 2.49 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.591 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.4 mt -129.79 141.43 50.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.336 0.588 . . . . 0.0 112.266 -178.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 mt-10 -107.88 139.06 43.05 Favored 'General case' 0 CA--C 1.502 -0.87 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.755 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.477 ' HA ' HD23 ' A' ' 35' ' ' LEU . 50.1 m -80.68 140.23 35.74 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.62 HG21 ' NE2' ' A' ' 23' ' ' GLN . 51.8 p -103.69 160.99 14.29 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.585 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 10.9 t -49.24 -29.13 5.32 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.93 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.7 t30 62.96 0.23 0.68 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.564 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.455 ' N ' ' HA ' ' A' ' 56' ' ' LYS . 74.5 p -143.91 62.12 1.36 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.09 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.455 ' HA ' ' N ' ' A' ' 55' ' ' SER . 94.1 mttt -114.44 133.45 55.73 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.292 0.637 . . . . 0.0 110.708 -0.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.52 ' O ' ' HB3' ' A' ' 53' ' ' SER . 6.0 p30 41.86 -132.27 0.44 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.387 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 56' ' ' LYS . 60.0 t 61.75 102.34 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.402 ' HG3' HG22 ' A' ' 52' ' ' THR . 5.6 Cg_exo -75.92 139.78 22.34 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 123.231 2.621 . . . . 0.0 111.556 178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -51.05 -37.94 58.42 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.388 2.059 . . . . 0.0 111.541 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -121.26 81.17 1.75 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.589 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.534 HD11 HG11 ' A' ' 21' ' ' VAL . 44.6 tp -62.9 -30.93 71.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.492 -178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.9 m -47.62 -54.88 10.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.422 HD12 ' HB1' ' A' ' 38' ' ' ALA . 33.0 pt -68.54 -16.9 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.691 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -97.01 -0.39 47.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.075 0.464 . . . . 0.0 111.305 -179.183 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 29.3 m -85.27 134.12 34.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.349 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -138.27 162.5 34.18 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.101 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.581 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.4 t -126.8 134.57 65.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.71 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD23 ' CD2' ' A' ' 121' ' ' LEU . 16.4 mt -83.25 64.93 8.01 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.51 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.8 mm-40 -44.25 -62.9 1.0 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -178.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.408 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 56.7 mm-40 -122.91 163.08 21.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.705 0.764 . . . . 0.0 112.897 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.7 t -155.34 85.08 1.06 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.478 -1.237 . . . . 0.0 108.951 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.33 158.14 20.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.8 p -71.13 146.83 48.95 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.1 t -49.92 -45.72 22.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 121.083 0.468 . . . . 0.0 110.195 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 21.2 ttp85 -55.44 -54.24 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.454 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -60.97 -45.31 95.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.821 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.4 tp -59.06 -44.55 91.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.281 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -67.95 -34.82 77.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -66.12 -41.07 91.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.738 179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.406 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 66.2 mtt -64.62 -44.92 89.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.5 mt -67.66 -34.82 77.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.08 -33.3 74.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -72.92 -18.76 61.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.559 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 80.9 p -91.22 -4.37 56.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.602 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.9 t -77.34 -26.72 15.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.36 -179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -104.9 147.99 27.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.858 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 88' ' ' LYS . 3.2 mptp? -82.16 99.85 9.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.945 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 59.1 p -141.01 -63.77 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.698 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 55.44 -164.28 0.13 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.142 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 108.97 -10.91 34.43 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.587 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -83.89 89.12 7.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.855 0.359 . . . . 0.0 110.791 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.7 m -141.23 -175.45 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.999 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' A' ' 97' ' ' LYS . 5.4 p-10 -82.61 77.54 9.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.508 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 19.4 m -83.42 1.65 3.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.701 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.809 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 3.2 mm-40 -54.01 -37.91 64.55 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.789 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.809 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 54.0 pttt -87.5 -50.98 6.18 Favored 'General case' 0 C--N 1.353 0.723 0 CA-C-N 120.372 1.442 . . . . 0.0 111.691 -3.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.413 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 65.7 p-90 -63.99 -28.8 70.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.948 -177.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.8 tmtm? -61.8 -41.66 98.02 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.776 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.769 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 45.3 t80 -74.18 -45.17 50.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.123 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 51.4 ttp -56.57 -42.86 79.32 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.653 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 25.2 mmt -73.55 -40.07 64.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.163 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -57.51 -45.8 84.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.891 0.377 . . . . 0.0 110.626 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 52.4 p -70.09 -47.05 63.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.893 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.08 -23.53 66.57 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.09 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -88.05 -35.66 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -79.84 -66.85 1.63 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.345 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 56.83 -97.12 0.06 OUTLIER Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.732 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 110' ' ' HIS . . . -137.42 -164.21 9.97 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.424 ' HA ' ' HA3' ' A' ' 109' ' ' GLY . 17.6 m80 -108.32 -164.05 0.93 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 117.953 0.877 . . . . 0.0 110.609 0.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -152.55 142.13 21.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.01 0.433 . . . . 0.0 111.115 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.471 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 63.1 m -71.64 147.23 47.72 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.255 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.7 mp -82.63 131.39 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.424 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.5 mt -115.58 141.58 47.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.291 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -61.98 129.58 41.58 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.983 0.42 . . . . 0.0 110.491 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.78 -13.14 57.88 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.051 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.49 140.89 33.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.04 0.448 . . . . 0.0 111.324 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.12 126.25 31.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.6 pt -112.06 158.26 12.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.527 0.679 . . . . 0.0 112.77 -178.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 153' ' ' THR . 20.6 tp -114.26 109.97 19.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.966 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' CD2' HD23 ' A' ' 69' ' ' LEU . 53.5 mt -97.0 116.48 29.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.688 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.581 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.9 ttp85 -102.85 117.11 33.91 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.795 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 26.1 t-80 -59.72 108.58 0.76 Allowed 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 177.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.0 t -53.02 -45.31 67.89 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 53.7 t80 -65.16 -57.56 8.24 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.21 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.445 ' OG ' HD13 ' A' ' 149' ' ' LEU . 57.8 p -79.82 -15.39 57.51 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.63 -0.49 56.03 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.432 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 51.6 mtt -83.23 -165.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.466 0.175 . . . . 0.0 110.566 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 70.4 m-85 -134.09 138.11 45.06 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.472 HD13 HD21 ' A' ' 37' ' ' LEU . 23.0 tp -54.97 125.62 21.11 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.7 t -134.37 146.92 50.36 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 49.7 t -93.6 97.18 10.32 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.0 mt -73.66 153.26 40.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.467 -178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.0 t -83.6 2.88 35.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.814 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 50.2 p -89.79 122.49 32.91 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.771 0.319 . . . . 0.0 110.909 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.4 ' HB3' ' H ' ' A' ' 142' ' ' LYS . 57.5 m -62.73 -58.86 5.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.747 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -140.52 -70.99 0.37 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.058 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.7 t -158.44 -51.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.986 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.4 m -123.17 -36.63 2.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.073 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.0 t -87.25 163.58 16.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.094 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -124.41 102.03 7.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.974 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.4 ' H ' ' HB3' ' A' ' 136' ' ' SER . 36.9 mtmm -111.56 -167.88 1.24 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.936 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 143' ' ' LEU . 3.5 mm? -57.82 -85.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.271 0.558 . . . . 0.0 111.143 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -49.93 148.23 3.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.166 -0.925 . . . . 0.0 113.206 -178.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 16.7 m-85 -104.45 177.06 4.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.425 -1.261 . . . . 0.0 108.692 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -94.18 141.62 28.34 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 65.4 t -112.43 116.98 54.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.32 178.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -133.39 -147.9 5.8 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.758 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.445 HD13 ' OG ' ' A' ' 126' ' ' SER . 68.1 mt -116.74 151.89 35.46 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.87 0.366 . . . . 0.0 110.58 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -141.23 136.08 31.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.805 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -69.45 -46.84 65.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -87.15 147.75 25.48 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.754 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.43 HG21 HD21 ' A' ' 120' ' ' LEU . 82.4 p -107.03 -7.6 16.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.62 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.6 p -53.87 116.78 2.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.502 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.21 -161.52 19.69 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.686 -0.769 . . . . 0.0 111.495 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.464 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 45.3 mt-10 -118.34 -15.19 9.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.741 0.305 . . . . 0.0 111.271 -179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.3 -32.17 68.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.126 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.3 m -88.15 4.5 45.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.478 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -109.8 135.35 50.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.044 0.449 . . . . 0.0 111.207 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.441 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.0 m95 -128.74 116.57 19.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.604 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.8 p -78.59 124.6 28.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.072 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.475 HD12 HG21 ' A' ' 175' ' ' VAL . 3.9 pt -87.16 136.56 22.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.828 0.347 . . . . 0.0 110.936 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.45 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 71.3 m80 -128.06 150.03 72.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.618 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.8 Cg_endo -66.26 138.22 50.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.497 2.131 . . . . 0.0 112.483 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.18 -43.39 52.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.581 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 50.4 m -105.1 -170.7 1.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.286 -179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -92.44 -12.53 31.87 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -67.38 -35.48 79.41 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.318 -179.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.618 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.2 mmt-85 -87.47 146.04 26.01 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.3 t -128.68 168.22 16.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.899 0.38 . . . . 0.0 111.411 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.71 132.28 47.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.151 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.56 -14.63 64.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.749 -0.739 . . . . 0.0 111.947 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -70.75 155.7 40.44 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.011 0.434 . . . . 0.0 111.258 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 38.9 mttp -71.53 144.13 49.71 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.48 178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.481 HG13 HD21 ' A' ' 181' ' ' LEU . 80.0 t -94.84 111.14 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.409 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.89 154.54 35.95 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.399 0.618 . . . . 0.0 111.572 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . . . . . . . . . 33.4 t -69.48 123.0 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.326 0 N-CA-C 107.151 -1.425 . . . . 0.0 107.151 176.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -18.21 30.86 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -63.95 130.3 43.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.721 0.296 . . . . 0.0 110.739 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.619 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 8.9 m-20 -72.34 115.31 11.43 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.481 HD21 HG13 ' A' ' 175' ' ' VAL . 66.8 mt -99.5 147.37 25.37 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 121.745 0.783 . . . . 0.0 112.911 -178.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.45 ' HB ' ' HB2' ' A' ' 163' ' ' HIS . 58.4 mt -112.81 112.29 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.6 mp -92.49 136.67 33.01 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.943 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.466 HG22 ' CD1' ' A' ' 191' ' ' TYR . 83.4 t -130.46 125.51 59.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.793 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 17.9 m -61.2 129.0 39.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.464 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.3 t -72.54 -32.48 41.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.548 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 42.4 t -79.93 -37.28 34.87 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.526 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 50.5 m -114.07 0.5 14.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 51.18 27.59 3.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 179.466 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.433 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 1.9 mtt-85 -108.14 142.41 38.4 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.03 0.443 . . . . 0.0 111.124 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.509 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.2 m-85 -72.95 153.14 41.09 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.414 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 35.0 tp -75.76 74.86 2.73 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 175.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -74.2 150.17 40.5 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -174.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . 0.529 HD22 ' SG ' ' A' ' 24' ' ' CYS . 12.5 tp -99.82 116.22 31.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.522 176.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.412 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 45.3 t -110.05 147.8 32.9 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -177.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -107.64 89.76 3.09 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.526 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -78.75 -174.94 45.43 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.361 179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.526 ' C ' ' O ' ' A' ' 197' ' ' GLY . 22.6 m-80 1.75 -79.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.435 0.694 . . . . 0.0 112.401 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 38.8 t -146.95 11.56 1.07 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.0 t -125.45 -179.17 4.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.752 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.624 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -107.24 136.08 47.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.16 0.505 . . . . 0.0 111.27 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.467 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 27.9 m-70 -127.9 173.29 10.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.007 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.8 p -127.75 131.63 69.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.103 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -148.2 173.45 12.98 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.809 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.04 91.36 4.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.165 178.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -109.89 -179.82 3.91 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -88.18 7.7 30.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.214 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -116.51 137.33 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.608 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -64.73 175.44 1.46 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.399 1.095 . . . . 0.0 113.287 -178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.2 m -169.71 120.78 0.68 Allowed 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 112.895 -1.957 . . . . 0.0 107.842 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.619 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 42.0 mt -74.47 132.8 42.21 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.937 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.414 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 97.9 m95 -121.31 118.24 29.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.489 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 23' ' ' GLN . 33.7 p -85.4 101.44 12.6 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.059 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.767 HG22 ' HG ' ' A' ' 22' ' ' LEU . 84.6 t -92.78 104.81 16.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.86 139.42 23.51 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.249 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 217' ' ' ILE . 33.1 Cg_exo -62.16 105.81 0.42 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.09 1.86 . . . . 0.0 111.266 178.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.574 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.156 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.438 HE21 ' N ' ' A' ' 12' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.778 0.323 . . . . 0.0 110.566 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -120.56 151.09 39.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.46 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 29.3 mt -76.64 128.32 34.48 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 9.7 mmt85 -116.53 157.78 24.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.328 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -68.29 155.51 39.59 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.748 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.93 -8.26 1.31 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.441 ' HB2' HD12 ' A' ' 69' ' ' LEU . 3.0 m-20 -69.15 143.02 54.21 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.902 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 216' ' ' PRO . 15.3 tt0 -89.57 116.29 27.61 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.537 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.3 m -132.54 175.65 10.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.687 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.3 m -135.15 142.03 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.575 176.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.772 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.8 mp -103.53 117.91 35.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.555 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.525 ' NE2' HG21 ' A' ' 52' ' ' THR . 42.5 mt-30 -118.97 149.94 40.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.674 0.75 . . . . 0.0 112.458 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.1 p -137.26 142.59 41.99 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.558 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.9 m -84.85 121.97 28.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.475 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.63 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -112.77 120.07 40.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.095 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 m -125.46 134.16 52.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.539 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 tt -170.77 145.43 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.486 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 37.5 m80 58.26 39.12 25.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.793 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 61.45 25.61 15.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.258 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -127.33 133.47 50.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.282 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -122.64 148.71 44.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.015 0.436 . . . . 0.0 111.474 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -161.85 173.1 15.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.553 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -120.53 136.54 54.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.569 178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.8 mt -125.78 141.03 52.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.533 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.645 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 51.4 t -104.75 146.23 29.25 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.491 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.502 HD21 HD13 ' A' ' 130' ' ' LEU . 31.9 tp -65.34 112.6 3.57 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.943 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.51 163.8 13.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.571 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.4 164.92 10.7 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.703 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.07 143.53 42.66 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.69 179.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.22 18.73 21.36 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.277 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -124.72 147.55 48.56 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.774 0.321 . . . . 0.0 110.458 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.42 -138.75 20.18 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.485 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -80.51 7.56 9.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.734 0.302 . . . . 0.0 110.787 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.447 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.77 32.44 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.095 179.619 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.6 mt -78.08 137.61 38.32 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.034 0.445 . . . . 0.0 110.449 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -78.85 150.81 32.15 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.583 0.706 . . . . 0.0 111.449 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 p90 -145.21 -166.28 2.38 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.589 -1.187 . . . . 0.0 108.488 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 35' ' ' LEU . 25.8 mt -129.09 142.51 50.87 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.403 0.62 . . . . 0.0 112.096 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.1 tt0 -110.64 138.47 46.99 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.797 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.459 ' O ' ' HD2' ' A' ' 60' ' ' PRO . 49.3 m -76.66 146.08 38.36 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 76.7 p -104.59 120.86 42.27 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.995 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.486 ' HB3' ' O ' ' A' ' 57' ' ' ASN . 19.2 t 17.02 54.7 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 O-C-N 124.306 1.004 . . . . 0.0 112.789 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m120 51.14 -88.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.336 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.417 ' N ' ' O ' ' A' ' 53' ' ' SER . 72.3 p -116.68 99.28 7.02 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.931 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -153.61 13.99 0.48 Allowed 'General case' 0 C--N 1.344 0.331 0 C-N-CA 123.205 0.602 . . . . 0.0 110.712 0.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.486 ' O ' ' HB3' ' A' ' 53' ' ' SER . 21.9 p-10 -132.13 176.99 7.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 42.0 t 61.3 104.1 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.529 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 2.8 Cg_exo -76.72 139.5 20.04 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 123.211 2.607 . . . . 0.0 111.5 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.459 ' HD2' ' O ' ' A' ' 51' ' ' SER . 9.4 Cg_endo -51.36 -39.22 63.59 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.383 2.055 . . . . 0.0 111.315 179.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -121.71 84.34 2.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.686 179.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 HG11 ' A' ' 21' ' ' VAL . 46.1 tp -64.91 -30.73 71.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.17 -178.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.1 m -46.69 -54.0 10.53 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.464 HD12 ' HB1' ' A' ' 38' ' ' ALA . 29.9 pt -69.01 -18.71 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.687 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.87 -2.21 47.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.265 0.555 . . . . 0.0 111.068 -179.456 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.411 HG23 ' HG2' ' A' ' 19' ' ' GLU . 30.4 m -84.7 133.01 34.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.387 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -137.88 162.69 33.36 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.007 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.556 HG21 ' NH2' ' A' ' 122' ' ' ARG . 3.1 t -126.42 133.64 68.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.786 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 18' ' ' ASP . 15.0 mt -82.69 65.4 7.8 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.509 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.8 mm-40 -45.01 -61.22 1.71 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -124.57 164.66 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.651 0.739 . . . . 0.0 112.796 -177.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 57.1 m -157.47 86.73 0.94 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.03 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -115.17 154.84 28.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.271 -179.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 46.7 t -68.55 150.49 47.97 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 45.9 t -51.82 -43.51 34.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.078 0.466 . . . . 0.0 110.162 179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HB3' ' NH1' ' A' ' 76' ' ' ARG . 18.4 ttp-105 -56.58 -57.13 13.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.912 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.61 89.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.091 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 16.6 tp -61.83 -46.49 89.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.256 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -66.63 -33.0 74.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.958 0.409 . . . . 0.0 110.488 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -66.66 -42.84 85.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.681 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -64.44 -42.42 95.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.757 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.402 ' O ' HG23 ' A' ' 86' ' ' VAL . 87.3 mt -69.17 -33.39 73.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.642 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.75 -31.81 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.6 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -71.27 -24.08 62.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.46 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 81.6 p -82.54 -7.19 59.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.845 0.355 . . . . 0.0 111.32 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 82' ' ' LEU . 21.6 t -88.88 -24.98 5.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.975 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.69 -68.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.171 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -149.41 -61.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.808 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 80.4 p -60.59 132.28 53.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.735 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -155.43 122.1 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.792 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 99.12 15.45 33.06 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -143.4 151.17 40.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.742 0.306 . . . . 0.0 110.774 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.1 p -144.87 -34.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -76.11 85.37 2.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.832 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.7 m -86.04 -5.25 9.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.772 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.823 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 10.0 mm-40 -53.8 -41.69 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 118.666 -0.683 . . . . 0.0 112.635 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.738 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 27.3 tttm -86.32 -50.86 6.62 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 125.469 1.508 . . . . 0.0 111.641 -2.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -57.53 -35.52 70.39 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.041 -1.436 . . . . 0.0 113.264 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.653 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 12.8 mmmm -64.18 -33.77 76.56 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.45 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.823 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 7.7 t80 -74.17 -49.43 23.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.224 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 50.0 ttm -59.45 -44.32 92.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.219 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 27.4 ttt -70.15 -49.25 52.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.534 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.8 -38.4 75.45 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.047 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 90.6 m -71.78 -46.77 57.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.83 -54.35 48.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.572 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -70.92 -34.06 71.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.087 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.82 3.08 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.373 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 60.06 46.2 94.6 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.687 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 132.31 175.94 14.2 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.674 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -151.73 166.96 29.72 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.381 0.59 . . . . 0.0 110.833 0.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -159.89 150.72 19.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.019 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 84.4 m -78.98 144.28 34.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.411 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.09 130.39 35.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 82.4 mt -115.15 142.36 46.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.332 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.11 130.74 46.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.044 0.45 . . . . 0.0 110.529 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.6 -13.04 59.71 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.069 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.409 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.4 OUTLIER -83.05 140.02 32.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.022 0.439 . . . . 0.0 111.456 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.434 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.99 128.18 33.82 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.5 pt -112.65 159.72 12.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.649 0.738 . . . . 0.0 112.935 -178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 21.4 tp -115.66 107.19 14.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.686 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.406 ' CD2' HD23 ' A' ' 69' ' ' LEU . 47.1 mt -95.37 117.62 30.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.74 -178.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 68' ' ' VAL . 62.3 ttp85 -104.04 116.04 31.52 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.696 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 22.6 t-80 -57.69 110.71 0.94 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 177.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 47.9 t -52.76 -52.46 56.42 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 48.6 t80 -57.73 -66.9 0.39 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 60.0 p -66.72 -33.06 74.81 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 91.02 -3.11 80.44 Favored Glycine 0 C--N 1.322 -0.204 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.676 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 48.3 mtt -81.94 -165.5 1.0 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.716 -0.242 . . . . 0.0 110.434 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.496 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.7 m-85 -133.46 139.25 46.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.502 HD13 HD21 ' A' ' 37' ' ' LEU . 26.0 tp -54.66 127.14 26.77 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 52.8 t -136.5 143.99 44.07 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 51.4 t -91.82 97.83 11.23 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.511 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 14.5 mt -73.76 145.31 45.18 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.522 -178.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 80.5 p -76.71 -0.04 22.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.757 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.6 p -91.25 120.44 32.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 110.94 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.527 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 49.4 m -63.05 -56.61 15.44 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.779 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -152.47 -23.49 0.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.795 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.8 p -147.77 -64.02 0.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.036 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 80.7 p -165.1 -7.43 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 6.8 t -92.42 164.86 13.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.139 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -91.66 131.53 36.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.73 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.509 ' HB2' ' HB3' ' A' ' 136' ' ' SER . 35.1 mmtp -140.63 -170.94 3.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.927 0.394 . . . . 0.0 111.343 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.52 -61.46 2.61 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.396 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -104.7 157.21 17.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.139 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 136' ' ' SER . 14.5 m-85 -103.85 172.72 6.65 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.995 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.26 144.63 25.67 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 120.995 0.426 . . . . 0.0 109.867 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 74.8 t -114.13 117.9 56.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.288 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.84 -150.44 5.81 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.431 -0.89 . . . . 0.0 113.008 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.447 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 65.7 mt -114.89 151.96 33.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.925 0.393 . . . . 0.0 110.776 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -140.14 142.76 35.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.859 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.61 -51.62 11.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.529 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -83.27 146.25 28.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.0 p -106.54 -7.72 17.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 65.8 p -54.73 114.07 1.56 Allowed 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.49 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 128.06 -160.06 21.84 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.706 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.427 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.6 mt-10 -118.85 -14.85 9.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.745 0.307 . . . . 0.0 111.429 -179.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.3 -34.35 66.41 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 76.4 m -89.51 8.01 33.29 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -111.02 133.51 53.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.104 0.478 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.451 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.3 m95 -128.13 115.98 19.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.741 -179.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 13.5 p -78.35 126.36 30.66 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.208 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 175' ' ' VAL . 3.3 pt -88.38 136.18 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.421 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 70.4 m80 -129.25 151.47 77.84 Favored Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.187 -179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.692 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 37.7 Cg_endo -66.67 140.16 55.47 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.593 2.195 . . . . 0.0 112.397 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.73 51.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.746 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 7.7 t -110.79 -168.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.441 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -95.57 4.75 52.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.333 -179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -84.04 -30.65 25.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.905 0.383 . . . . 0.0 111.004 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 70.0 mmt-85 -92.27 144.23 25.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 49.7 m -124.94 164.79 19.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.935 0.397 . . . . 0.0 111.64 -178.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.465 ' H ' ' CD ' ' A' ' 171' ' ' GLU . 0.0 OUTLIER -65.69 130.64 43.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.317 179.427 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.7 -16.95 60.22 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.027 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -67.79 156.18 37.62 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.952 0.406 . . . . 0.0 111.093 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -72.23 144.67 48.37 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.507 HG13 HD21 ' A' ' 181' ' ' LEU . 95.5 t -94.68 113.23 28.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -77.0 155.0 32.91 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.343 0.592 . . . . 0.0 111.649 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.442 HG13 ' HD2' ' A' ' 216' ' ' PRO . 22.8 t -69.93 119.91 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 176.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.94 -13.76 31.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.309 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -66.38 132.48 48.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.813 0.339 . . . . 0.0 110.932 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.511 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.2 m-20 -73.49 110.46 7.8 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.747 178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.507 HD21 HG13 ' A' ' 175' ' ' VAL . 56.6 mt -97.34 150.64 20.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.748 0.785 . . . . 0.0 112.985 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.501 HD13 ' NE2' ' A' ' 209' ' ' GLN . 48.0 mt -115.61 113.07 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 176.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -92.64 136.37 33.28 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.028 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.469 HG22 ' CD1' ' A' ' 191' ' ' TYR . 76.1 t -128.47 127.61 67.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.812 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 6.6 m -65.3 125.08 23.95 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.427 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 92.1 t -69.54 -30.36 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.963 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 94.1 p -79.94 -37.0 35.42 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.403 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 73.9 p -120.2 9.31 11.06 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 46.26 31.96 1.37 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 179.386 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 24.2 mtt180 -111.05 140.42 45.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.085 0.469 . . . . 0.0 110.983 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.5 m-85 -72.84 153.61 40.98 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 32.6 tp -75.57 75.93 2.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 175.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -75.26 151.07 38.41 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 115.68 1.734 . . . . 0.0 115.68 -174.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 14.2 tp -100.42 117.45 34.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 113.724 -1.58 . . . . 0.0 107.585 177.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 34.1 t -112.03 146.03 38.63 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -105.32 92.67 4.3 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.531 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.2 -173.85 44.76 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.375 -0.916 . . . . 0.0 111.419 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.531 ' C ' ' O ' ' A' ' 197' ' ' GLY . 17.1 m120 -3.28 -76.3 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.362 0.665 . . . . 0.0 112.51 -179.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 78.2 p -147.7 13.72 1.05 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.116 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 32.1 t -128.42 179.45 5.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.743 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.63 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.9 m95 -106.07 136.45 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.219 0.533 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.516 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 23.0 m-70 -128.19 173.11 10.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.029 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.7 p -127.57 131.06 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.146 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -147.52 173.11 12.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.683 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.5 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -100.22 93.91 5.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.152 178.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.98 176.86 4.84 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.304 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -85.69 10.11 14.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.072 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -118.09 134.59 54.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.687 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.501 ' NE2' HD13 ' A' ' 182' ' ' ILE . 95.4 mt-30 -63.62 174.7 1.27 Allowed 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 122.389 1.09 . . . . 0.0 113.133 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 32.4 m -167.52 120.82 0.94 Allowed 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 112.939 -1.937 . . . . 0.0 107.734 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.511 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 32.6 mt -74.53 128.76 36.34 Favored 'General case' 0 C--N 1.317 -0.834 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.004 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -115.78 147.31 41.1 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.498 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.3 t -113.62 98.57 7.14 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.326 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' A' ' 22' ' ' LEU . 99.1 t -91.63 100.45 11.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -117.6 135.79 23.39 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.481 ' HA ' HG12 ' A' ' 20' ' ' VAL . 17.5 Cg_endo -60.07 107.14 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 121.835 1.69 . . . . 0.0 111.135 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.537 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.6 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.121 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.603 HE21 ' HB ' ' A' ' 177' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.829 0.347 . . . . 0.0 110.688 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -122.0 153.89 37.96 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.097 179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 14' ' ' LEU . 25.4 mt -80.53 121.94 26.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' A' ' 112' ' ' THR . 9.1 mmm180 -110.96 157.89 19.39 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.09 0.472 . . . . 0.0 111.287 -179.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 p -67.62 156.2 37.38 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.661 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 71.58 -4.25 1.93 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.818 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.42 ' HB2' HD12 ' A' ' 69' ' ' LEU . 2.9 m-20 -73.15 133.01 43.94 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.691 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -80.84 121.36 25.86 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 178.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.7 m -136.93 173.93 12.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 HD11 ' A' ' 62' ' ' LEU . 3.4 m -135.62 136.76 50.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.251 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -97.49 122.92 41.1 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.672 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 38.6 mt-30 -122.84 149.29 44.37 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.538 0.685 . . . . 0.0 112.029 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -136.18 144.07 44.76 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.627 178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.4 m -86.72 122.06 30.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.605 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.04 120.51 41.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.065 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.8 m -124.15 132.29 53.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.039 0.447 . . . . 0.0 111.761 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.1 tt -169.3 146.0 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.507 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 m80 59.79 39.66 20.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 3.7 mppt? 61.3 21.52 12.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.372 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -124.94 144.66 50.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.263 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -131.5 146.33 52.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.978 0.418 . . . . 0.0 111.384 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.403 HE21 ' HB2' ' A' ' 33' ' ' GLN . 2.2 pt20 -157.38 170.25 22.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.604 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.465 ' HZ3' ' HB3' ' A' ' 56' ' ' LYS . 27.7 mtmm -118.42 137.25 53.28 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.569 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.467 ' HB3' ' HB3' ' A' ' 49' ' ' LEU . 1.4 mt -125.71 143.68 50.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.601 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.4 p -107.94 139.72 42.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.968 0.413 . . . . 0.0 110.435 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 49' ' ' LEU . 34.4 tp -60.23 109.81 1.07 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.008 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.498 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -109.06 164.34 12.51 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.6 -179.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.16 162.03 10.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.766 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.95 142.83 44.63 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.557 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.22 23.17 8.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.366 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -130.57 147.12 52.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.872 0.367 . . . . 0.0 110.561 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.57 -125.34 6.99 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.856 -0.687 . . . . 0.0 112.519 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.422 ' HA ' HD22 ' A' ' 44' ' ' ASN . 1.5 t-20 -93.56 8.02 42.35 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.749 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.16 31.88 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.296 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 46' ' ' LEU . 17.5 mt -80.41 134.39 36.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.602 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.53 149.72 38.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.65 0.738 . . . . 0.0 111.163 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -146.07 -166.09 2.37 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.265 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 37' ' ' LEU . 24.7 mt -128.94 145.19 51.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.386 0.613 . . . . 0.0 111.736 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 tt0 -113.23 136.61 52.55 Favored 'General case' 0 CA--C 1.5 -0.951 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.767 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.484 ' O ' ' HD2' ' A' ' 60' ' ' PRO . 43.9 t -75.88 145.12 40.77 Favored 'General case' 0 N--CA 1.437 -1.082 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 176.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.565 ' HA ' ' HA ' ' A' ' 59' ' ' PRO . 78.0 p -104.15 125.12 50.2 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.683 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 52' ' ' THR . 27.7 p 18.81 55.17 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.209 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 59.88 -81.01 0.02 OUTLIER 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.713 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.457 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 67.5 m -157.17 103.82 2.03 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.978 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.736 ' HZ2' ' HB2' ' A' ' 56' ' ' LYS . 9.7 mtmp? -143.38 -173.31 3.9 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 123.623 0.769 . . . . 0.0 110.548 -0.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.492 ' C ' ' HB ' ' A' ' 52' ' ' THR . 26.7 m-80 63.48 162.63 0.11 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.344 0.592 . . . . 0.0 112.258 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 42.6 t 60.51 99.47 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.565 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 6.3 Cg_exo -79.85 139.95 14.2 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 123.352 2.702 . . . . 0.0 111.326 177.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' O ' ' A' ' 51' ' ' SER . 8.8 Cg_endo -51.44 -39.7 63.77 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.358 2.038 . . . . 0.0 111.399 179.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.404 ' O ' HG12 ' A' ' 64' ' ' ILE . 13.2 t70 -122.84 84.98 2.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.777 179.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.642 HD11 HG11 ' A' ' 21' ' ' VAL . 46.4 tp -67.02 -27.46 67.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.283 -178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.4 m -49.73 -51.76 36.48 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.498 HD12 ' HB1' ' A' ' 38' ' ' ALA . 27.8 pt -67.38 -18.4 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -178.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 58.4 m -100.63 14.15 32.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.652 0.263 . . . . 0.0 111.334 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -91.86 129.82 37.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -136.93 158.7 43.85 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.138 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 t -122.8 132.7 70.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.694 178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 18' ' ' ASP . 21.9 mt -80.73 67.59 6.66 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 178.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.485 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 12.1 mm-40 -46.81 -63.99 0.88 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.426 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.5 mm100 -123.01 162.08 23.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.712 0.768 . . . . 0.0 112.922 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.5 p -153.59 86.2 1.2 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.919 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.414 HD13 ' SD ' ' A' ' 81' ' ' MET . 7.2 mt -115.8 157.03 25.0 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.661 -178.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.2 t -70.02 150.74 46.32 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 44.8 t -52.84 -42.87 44.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.899 0.38 . . . . 0.0 110.323 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.1 ttp-105 -58.92 -56.87 16.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.87 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.53 82.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.81 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.4 -44.63 94.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.119 -179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -68.3 -33.86 75.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 0.0 110.52 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.46 -40.83 89.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.561 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.454 ' O ' HG23 ' A' ' 85' ' ' THR . 66.8 mtt -65.72 -45.35 83.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.738 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 64.4 mt -65.0 -36.56 84.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.615 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.48 -35.57 79.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.193 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -76.45 -20.76 56.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.383 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 81' ' ' MET . 56.0 p -85.85 0.69 52.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.925 0.393 . . . . 0.0 111.297 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.99 -31.74 15.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.825 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.78 168.3 11.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.625 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -66.88 110.35 3.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.024 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.9 p -121.35 173.99 7.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.849 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -82.42 -75.23 0.31 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.905 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.31 36.39 89.35 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.512 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -75.54 164.45 26.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.695 0.284 . . . . 0.0 110.662 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 23.0 m -74.65 -174.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.94 0.4 . . . . 0.0 111.636 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.562 ' HB2' ' HB3' ' A' ' 100' ' ' PHE . 1.8 p-10 -56.29 107.65 0.39 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.153 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.6 m -83.88 -1.97 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.229 -0.441 . . . . 0.0 112.175 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.78 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 0.2 OUTLIER -53.77 -41.5 67.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.454 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.78 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 9.4 mtmp? -88.63 -51.82 5.48 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 125.008 1.323 . . . . 0.0 111.038 -3.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -64.85 -28.57 69.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.787 -1.551 . . . . 0.0 112.676 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 96' ' ' GLU . 41.4 ttmt -61.15 -41.66 97.15 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.634 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.615 ' H ' ' CB ' ' A' ' 96' ' ' GLU . 53.3 t80 -73.84 -45.67 49.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.958 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 24.3 ttt -56.63 -39.03 72.94 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.759 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 21.9 mmt -74.06 -45.65 48.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.138 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -57.44 -40.99 79.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.755 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 60.2 p -72.93 -45.65 56.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.299 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.42 -46.46 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.274 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -82.83 -29.19 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.665 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.16 -16.43 79.67 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.477 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -50.08 130.86 28.62 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.603 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.654 ' H ' ' HB2' ' A' ' 110' ' ' HIS . . . -149.82 -65.94 0.01 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.788 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.654 ' HB2' ' H ' ' A' ' 109' ' ' GLY . 56.5 t-80 -138.05 -25.09 0.98 Allowed 'General case' 0 C--N 1.344 0.338 0 CA-C-N 117.828 0.814 . . . . 0.0 111.021 0.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -155.66 148.43 24.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.462 . . . . 0.0 111.639 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.507 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 86.5 m -79.11 146.49 33.18 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.0 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.2 mp -80.41 131.63 35.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.576 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.96 142.91 46.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.297 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -62.89 129.8 42.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.119 0.485 . . . . 0.0 110.443 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.6 -13.3 58.1 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.197 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.65 139.91 33.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.029 0.442 . . . . 0.0 111.456 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 161' ' ' THR . . . -81.6 127.25 32.67 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.26 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.462 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.2 pt -111.87 159.71 11.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.606 0.717 . . . . 0.0 112.789 -178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.426 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -115.39 109.18 17.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.935 -179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.416 ' CD2' HD23 ' A' ' 69' ' ' LEU . 59.3 mt -97.12 118.41 33.48 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.675 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.485 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 15.8 ttp-105 -104.24 116.59 32.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.67 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 27.2 t-80 -59.78 106.75 0.52 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -51.49 -44.71 62.57 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -177.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 26.2 t80 -65.6 -59.17 4.23 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 149' ' ' LEU . 59.8 p -78.2 -14.49 59.43 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' HIS . . . 73.42 0.87 55.86 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.383 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 52.1 mtt -84.58 -164.79 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.441 0.162 . . . . 0.0 110.64 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.423 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 65.1 m-85 -134.85 138.8 44.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.439 HD13 HD21 ' A' ' 37' ' ' LEU . 24.5 tp -55.97 124.8 18.92 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.593 ' SG ' HD21 ' A' ' 133' ' ' LEU . 19.3 p -134.5 147.72 50.4 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.4 t -93.76 98.52 11.15 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 114.643 -1.162 . . . . 0.0 107.891 177.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.593 HD21 ' SG ' ' A' ' 131' ' ' CYS . 14.1 mt -75.7 149.67 38.04 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.283 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.7 t -80.63 4.56 18.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.861 -179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . 0.403 HG22 ' HA ' ' A' ' 139' ' ' SER . 79.8 p -93.5 118.87 31.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.755 0.312 . . . . 0.0 111.263 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 48.4 t -66.08 -60.01 3.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.251 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.565 ' HA ' ' HE ' ' A' ' 137' ' ' ARG . 1.4 mmp_? -133.85 -37.57 0.91 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.005 179.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 41.3 t -162.18 78.41 0.51 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.559 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.403 ' HA ' HG22 ' A' ' 135' ' ' THR . 32.1 t 59.05 39.04 23.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.891 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 61.8 p -132.21 -169.16 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -144.62 103.66 3.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.707 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.417 ' H ' ' HB2' ' A' ' 136' ' ' SER . 68.2 mttm -145.81 102.49 3.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.548 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.425 ' O ' ' NH1' ' A' ' 190' ' ' ARG . 4.4 mm? 59.9 -81.45 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.653 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -100.86 153.77 19.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.518 0.675 . . . . 0.0 112.44 -178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.534 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 11.0 m-85 -103.32 171.62 7.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.655 -1.157 . . . . 0.0 108.907 177.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -91.01 144.05 26.07 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 73.6 t -113.72 118.53 58.53 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.242 178.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -136.21 -150.48 5.9 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.148 -1.025 . . . . 0.0 113.172 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 81.0 mt -116.55 143.63 45.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.051 0.453 . . . . 0.0 110.832 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 131' ' ' CYS . 1.8 tp60 -131.74 140.82 49.36 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.583 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.6 -51.49 19.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.509 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.468 ' HB3' HG22 ' A' ' 154' ' ' THR . 10.0 m-20 -84.61 152.17 24.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.541 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 82.7 p -107.86 -3.93 18.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.731 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . 0.468 HG22 ' HB3' ' A' ' 152' ' ' ASP . 2.4 t -53.45 117.68 3.27 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.602 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 121.93 -161.29 16.11 Favored Glycine 0 N--CA 1.441 -0.992 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.829 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.528 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 41.1 mt-10 -118.89 -12.21 9.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.707 0.289 . . . . 0.0 111.23 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.34 -31.87 67.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 78.5 m -89.6 6.85 39.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.655 0.264 . . . . 0.0 111.503 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -110.9 131.8 54.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.08 0.467 . . . . 0.0 111.305 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.462 ' O ' HG12 ' A' ' 119' ' ' ILE . 54.5 m95 -127.14 115.27 18.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.711 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 118' ' ' ALA . 10.5 p -78.13 126.24 30.52 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.152 178.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.462 HD12 HG21 ' A' ' 175' ' ' VAL . 2.4 pt -87.57 135.19 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.922 0.391 . . . . 0.0 110.794 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.407 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 72.8 m80 -127.86 149.35 70.43 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.202 -179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.651 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 36.4 Cg_endo -65.4 136.69 47.97 Favored 'Trans proline' 0 CA--C 1.517 -0.341 0 C-N-CA 122.502 2.135 . . . . 0.0 112.323 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.423 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.08 -39.55 49.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.396 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 79.0 p -104.85 -173.12 2.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.516 -179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -94.11 -7.09 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.931 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.445 ' HB2' ' NH1' ' A' ' 169' ' ' ARG . 2.3 mm100 -73.78 -34.03 64.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.092 -179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.651 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 69.7 mmt-85 -87.97 145.13 26.16 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.829 179.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 45.1 t -127.13 167.97 15.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.459 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -67.23 133.58 50.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.254 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.35 -16.99 58.55 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.132 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -68.04 156.33 37.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 120.916 0.389 . . . . 0.0 111.103 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -72.27 145.47 47.87 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.462 HG13 HD21 ' A' ' 181' ' ' LEU . 91.1 t -95.11 112.38 27.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 120.94 0.4 . . . . 0.0 110.263 179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -77.62 154.56 32.13 Favored 'General case' 0 CA--C 1.5 -0.954 0 CA-C-O 121.353 0.597 . . . . 0.0 111.595 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.603 ' HB ' HE21 ' A' ' 12' ' ' GLN . 45.7 t -70.53 122.14 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.89 -13.3 32.01 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.963 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -70.16 130.13 41.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.73 0.3 . . . . 0.0 110.741 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.486 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 10.4 m-20 -73.51 115.24 12.67 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 178.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.462 HD21 HG13 ' A' ' 175' ' ' VAL . 60.0 mt -99.84 149.79 23.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.818 0.818 . . . . 0.0 113.122 -178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.512 HD13 ' NE2' ' A' ' 209' ' ' GLN . 55.5 mt -114.26 113.17 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 176.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -92.84 136.87 32.86 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.175 0.512 . . . . 0.0 112.227 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.471 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.3 t -128.77 125.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.764 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 34.5 t -65.19 123.92 20.81 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 84.4 t -67.44 -33.53 62.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.063 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 48.3 t -78.74 -39.54 35.92 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 65.3 m -113.35 6.94 17.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -177.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 45.25 32.19 0.93 Allowed 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.425 ' NH1' ' O ' ' A' ' 143' ' ' LEU . 27.6 mtt180 -114.32 141.31 47.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.918 0.39 . . . . 0.0 110.73 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 53.0 m-85 -72.24 153.54 41.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 -178.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.412 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 34.3 tp -75.25 76.8 2.37 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 105.407 -2.072 . . . . 0.0 105.407 175.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -76.57 151.31 36.35 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -174.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.8 tp -100.64 117.3 34.48 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.672 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.429 ' HB2' ' OD2' ' A' ' 204' ' ' ASP . 42.7 t -111.23 146.33 37.14 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -105.86 90.31 3.35 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.527 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -77.12 -174.53 40.77 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.464 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' A' ' 197' ' ' GLY . 71.4 m-20 -2.12 -76.62 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.42 0.688 . . . . 0.0 112.594 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 39.7 t -147.62 12.68 1.03 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.05 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 66.8 p -127.25 -179.86 5.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.873 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.605 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 92.1 m95 -107.22 135.92 47.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.207 0.527 . . . . 0.0 111.198 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.484 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 24.3 m-70 -127.74 173.1 10.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.108 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.86 131.98 70.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.104 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.8 p30 -149.33 172.44 14.89 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.66 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -99.14 94.54 6.56 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.259 178.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.419 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -114.21 174.83 5.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.129 -177.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -83.76 9.37 12.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.038 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.434 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 13.7 mm100 -115.35 136.85 52.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.534 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.512 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.8 mt-30 -66.29 175.31 2.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 122.295 1.045 . . . . 0.0 113.047 -178.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 30.9 m -167.98 120.82 0.88 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 113.025 -1.898 . . . . 0.0 107.891 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.486 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 37.1 mt -74.74 127.59 33.52 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.561 -0.456 . . . . 0.0 109.976 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.413 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.3 m95 -114.71 146.75 40.56 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.617 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 42.2 m -113.76 100.04 8.16 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.222 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 22' ' ' LEU . 75.0 t -91.31 99.95 10.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.818 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.0 139.38 22.89 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.122 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.477 ' O ' HG12 ' A' ' 217' ' ' ILE . 24.8 Cg_exo -63.6 106.94 0.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.018 1.812 . . . . 0.0 111.197 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.499 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.3 mm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.313 -0.851 . . . . 0.0 110.976 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 79.6 mm-40 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.477 ' CD1' ' HD2' ' A' ' 176' ' ' ARG . 40.5 m-85 -127.7 151.65 48.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.562 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.8 mt -81.36 123.64 28.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -111.04 156.57 21.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.939 0.399 . . . . 0.0 111.069 -179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.8 p -67.19 155.65 38.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.844 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.43 -8.3 1.38 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.77 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.0 m-20 -69.05 132.27 46.35 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.913 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -79.29 123.03 27.07 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.484 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 23.0 m -138.23 169.78 17.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.678 ' HB ' ' SG ' ' A' ' 36' ' ' CYS . 2.5 m -132.74 136.19 56.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.335 176.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.716 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.4 mp -97.19 126.09 42.16 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.808 0.337 . . . . 0.0 110.918 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HA ' ' O ' ' A' ' 35' ' ' LEU . 44.1 mt-30 -125.14 151.06 46.26 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.488 0.661 . . . . 0.0 111.787 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -137.63 144.12 41.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.541 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.7 m -86.12 122.03 29.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.327 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.615 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -115.07 121.99 44.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.144 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.2 m -125.63 137.66 53.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.991 0.424 . . . . 0.0 111.616 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.0 tt -174.16 143.32 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.582 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 43.5 m80 59.64 39.34 21.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.005 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.429 ' N ' ' HE2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 62.4 22.6 13.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.378 179.589 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -126.67 129.09 47.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.612 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -119.61 145.85 46.06 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.26 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -156.74 174.3 15.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.683 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.536 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 28.0 mtmm -121.41 135.88 55.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.478 178.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.8 mt -123.69 143.88 49.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.72 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.678 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 4.3 t -107.11 135.05 49.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.977 0.418 . . . . 0.0 110.56 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HA ' HD23 ' A' ' 49' ' ' LEU . 37.9 tp -59.89 103.3 0.2 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.882 179.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -101.56 164.61 11.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.634 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.59 158.63 11.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.545 179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -131.09 150.09 52.31 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.75 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.07 -4.25 89.99 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.918 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -109.04 161.55 15.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.891 0.377 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 78.69 -141.63 24.76 Favored Glycine 0 C--N 1.332 0.357 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.294 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.437 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -84.38 11.86 7.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.776 0.322 . . . . 0.0 110.641 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 43.14 30.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.397 -0.819 . . . . 0.0 112.136 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.437 ' H ' HD22 ' A' ' 44' ' ' ASN . 53.6 mt -79.59 135.83 36.69 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 75.7 m -76.75 150.84 36.19 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.304 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -144.89 -170.29 3.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.706 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 37' ' ' LEU . 21.6 mt -127.4 143.04 51.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.313 0.578 . . . . 0.0 112.141 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' CD ' HD11 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -111.47 138.33 48.13 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.662 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.506 ' HA ' HD23 ' A' ' 35' ' ' LEU . 32.7 t -77.49 145.83 36.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.486 ' C ' ' H ' ' A' ' 54' ' ' ASN . 72.4 p -103.97 177.22 4.9 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.312 179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 14.8 m -70.0 17.9 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.652 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.486 ' H ' ' C ' ' A' ' 52' ' ' THR . 27.3 t-20 64.42 -88.16 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.591 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 58.8 m -127.06 103.19 7.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.989 -179.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 47.1 mmtm -76.47 -179.71 5.37 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 123.074 0.549 . . . . 0.0 110.917 -0.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.721 HD22 ' H ' ' A' ' 58' ' ' VAL . 0.8 OUTLIER -60.41 -107.37 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.796 179.769 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.721 ' H ' HD22 ' A' ' 57' ' ' ASN . 21.8 t 61.68 101.41 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HA ' ' HA ' ' A' ' 52' ' ' THR . 6.6 Cg_exo -75.2 141.38 26.01 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.294 2.663 . . . . 0.0 111.53 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -47.83 -43.41 29.37 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 C-N-CA 122.543 2.162 . . . . 0.0 111.079 179.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.454 ' O ' HG12 ' A' ' 64' ' ' ILE . 11.1 t70 -119.25 91.89 3.66 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.09 178.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD11 HG11 ' A' ' 21' ' ' VAL . 43.3 tp -72.83 -29.34 63.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.292 -178.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.6 m -54.72 -40.01 68.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 38' ' ' ALA . 21.0 pt -71.66 -16.86 19.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -178.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 37' ' ' LEU . 16.6 t -105.59 4.8 30.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.247 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.1 m -76.24 125.92 30.05 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -134.2 161.18 35.63 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.8 t -125.11 133.19 70.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.673 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.414 HD12 ' HB2' ' A' ' 18' ' ' ASP . 23.1 mt -80.7 66.19 6.13 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 8.7 mm-40 -45.75 -61.39 1.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 55.5 mm-40 -124.37 164.36 19.82 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.662 0.744 . . . . 0.0 112.816 -177.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.0 t -156.43 84.51 0.98 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.829 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 mt -114.1 153.23 29.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.489 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.9 p -67.27 148.61 51.49 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 47.9 t -50.33 -42.51 20.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.976 0.417 . . . . 0.0 110.264 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 19.4 ttp85 -59.67 -50.47 73.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.14 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.03 99.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.755 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.33 -46.05 88.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.182 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -66.7 -33.01 74.69 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.971 0.415 . . . . 0.0 110.583 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -66.35 -43.65 85.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.463 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.41 ' O ' HG23 ' A' ' 85' ' ' THR . 68.0 mtt -64.46 -41.81 96.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.491 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -67.4 -35.45 79.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.444 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.96 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.614 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -74.39 -22.11 59.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.306 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 81' ' ' MET . 63.9 p -84.82 1.91 44.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.948 0.404 . . . . 0.0 111.18 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 47.7 t -82.34 -35.67 13.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.004 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -114.6 154.82 27.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.698 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.88 100.02 0.38 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.88 0.371 . . . . 0.0 110.746 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.5 m -155.34 127.59 7.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.007 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 62.07 -83.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.462 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 70.6 37.06 68.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.071 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -64.14 110.57 2.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.862 0.363 . . . . 0.0 111.104 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.03 -179.74 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.936 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.91 81.53 0.91 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.452 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.523 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 27.7 m -83.11 -2.39 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.164 -0.471 . . . . 0.0 112.024 -179.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.826 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 7.7 mm-40 -54.5 -37.79 65.73 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.826 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 51.6 mtmt -86.33 -51.59 6.15 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 120.353 1.433 . . . . 0.0 111.898 -2.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -60.51 -37.35 80.84 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.977 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.622 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 52.5 mttp -57.9 -38.03 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.276 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.821 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 10.1 t80 -74.04 -44.38 54.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.916 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 26.6 ttt -57.15 -37.95 72.82 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.431 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 26.3 mmt -72.36 -43.7 63.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.372 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -62.06 -34.53 76.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.585 179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 57.4 m -72.92 -49.05 31.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.279 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.98 44.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.391 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -70.07 -49.7 48.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.291 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.66 -58.58 13.13 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.618 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 62.79 -128.3 40.25 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -119.02 -82.77 0.81 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.558 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -95.43 -171.67 2.45 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.83 0.815 . . . . 0.0 110.736 -0.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -151.45 140.8 21.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.276 0.56 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 92.2 m -75.47 146.0 40.99 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.139 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.5 mp -80.33 134.33 36.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.7 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 82.1 mt -117.64 142.06 47.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.864 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -61.67 127.96 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.67 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.45 -9.43 55.83 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.968 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -85.39 139.42 31.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.095 0.474 . . . . 0.0 111.079 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.26 127.14 32.38 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 160' ' ' TRP . 45.8 pt -112.12 157.7 12.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.587 0.708 . . . . 0.0 112.854 -178.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.411 ' HB3' ' H ' ' A' ' 71' ' ' GLN . 21.7 tp -113.26 109.08 18.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.936 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.1 mt -97.06 117.71 31.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.485 -179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.554 ' NH2' HG21 ' A' ' 68' ' ' VAL . 60.2 ttp85 -104.22 117.79 35.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.689 179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 30.4 t-80 -60.02 105.45 0.4 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 107.672 -1.232 . . . . 0.0 107.672 177.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 45.7 t -46.5 -53.91 10.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.415 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 36.1 t80 -58.12 -71.48 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.13 0.418 . . . . 0.0 112.13 -178.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.402 ' OG ' HD13 ' A' ' 149' ' ' LEU . 77.9 p -62.21 -25.05 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . 0.513 ' HA2' HH11 ' A' ' 122' ' ' ARG . . . 81.87 -0.82 87.93 Favored Glycine 0 C--N 1.322 -0.234 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.288 -179.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 45.9 mtt -83.03 -164.61 0.9 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.489 0.185 . . . . 0.0 110.673 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.456 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 69.0 m-85 -135.61 139.28 43.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.56 126.1 23.86 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 39.7 t -136.06 147.97 48.12 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 52.8 t -94.42 99.07 11.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 12.8 mt -77.37 146.0 36.93 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.624 -178.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 59.9 m -74.92 -0.12 17.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.932 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 61.2 p -88.87 121.6 31.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.72 0.295 . . . . 0.0 110.974 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 42.0 t -71.63 -61.16 1.88 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.712 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 26.4 tpt180 -178.39 109.83 0.06 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.768 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.5 m 60.24 -85.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.4 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 52.5 m -152.07 -0.71 0.31 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 60.4 p -118.79 -172.26 2.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.329 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 63.69 158.46 0.08 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.229 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -155.35 -11.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.25 -66.21 0.52 Allowed 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 111.128 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -108.31 151.68 25.65 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.573 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 10.5 m-85 -99.49 170.49 8.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.141 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -90.15 143.14 27.04 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 71.2 t -112.86 116.76 53.52 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.003 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.275 178.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -134.05 -151.85 6.56 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.881 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 68.7 mt -113.89 147.0 39.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.81 0.338 . . . . 0.0 110.561 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -136.69 140.79 42.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.099 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -74.16 -47.94 32.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.594 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -84.99 146.89 26.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.1 p -107.98 -10.26 15.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.99 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 71.1 p -54.52 112.37 0.99 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.355 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 131.87 -158.44 22.86 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.341 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.473 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.2 mt-10 -121.8 -14.43 8.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.717 0.294 . . . . 0.0 111.24 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . 0.423 ' N ' ' HB2' ' A' ' 187' ' ' SER . . . -57.61 -32.79 67.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.174 -178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.3 m -89.45 5.97 42.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.604 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -110.19 132.56 54.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.111 0.481 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.452 ' O ' HG12 ' A' ' 119' ' ' ILE . 55.4 m95 -127.47 117.18 21.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.649 -179.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 7.7 p -79.13 128.01 32.75 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.133 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.553 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -89.26 134.33 28.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.937 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.478 ' HB2' ' HB ' ' A' ' 182' ' ' ILE . 69.8 m80 -127.96 151.85 76.46 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.291 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.666 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 43.6 Cg_endo -68.78 137.45 38.47 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.504 2.136 . . . . 0.0 112.291 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.415 ' CB ' HD22 ' A' ' 211' ' ' LEU . . . -77.45 -40.41 43.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.438 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 82.1 p -105.52 -171.12 1.85 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.499 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -95.51 -0.94 51.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.0 -36.06 49.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.989 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.666 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.2 mmp_? -87.57 149.45 24.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.525 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 47.7 t -131.75 161.74 32.13 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.017 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.27 126.75 29.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.137 179.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.61 -14.91 57.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.688 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.79 156.57 38.77 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 111.116 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -72.93 136.85 45.26 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.372 178.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.553 HG21 HD12 ' A' ' 162' ' ' ILE . 84.3 t -85.57 119.29 33.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.378 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 11.0 mmm180 -84.6 153.99 22.86 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-O 121.364 0.602 . . . . 0.0 111.513 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.423 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.9 t -69.66 122.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 107.28 -8.3 38.05 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.295 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -73.09 131.44 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.742 0.306 . . . . 0.0 110.9 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.514 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 24.5 m-20 -72.57 110.97 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.457 HD21 HG13 ' A' ' 175' ' ' VAL . 69.0 mt -97.51 149.68 21.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.505 HD13 ' NE2' ' A' ' 209' ' ' GLN . 54.4 mt -114.41 113.17 42.97 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.3 mp -93.13 138.6 31.4 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.101 0.477 . . . . 0.0 112.069 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.451 HG22 ' CD1' ' A' ' 191' ' ' TYR . 75.5 t -130.21 123.66 56.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.81 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 189' ' ' GLU . 87.5 p -65.23 119.15 10.37 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 95.1 t -63.17 -31.86 54.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.19 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . 0.423 ' HB2' ' N ' ' A' ' 157' ' ' ALA . 44.2 t -77.49 -39.2 47.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -178.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 54.7 m -116.66 9.89 14.21 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 185' ' ' SER . 0.4 OUTLIER 44.38 32.93 0.78 Allowed 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.584 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 29.0 mtt180 -113.31 140.27 48.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.95 0.405 . . . . 0.0 110.815 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 54.4 m-85 -72.17 153.62 41.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.419 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 31.1 tp -74.82 76.54 2.11 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 175.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.7 t60 -75.98 150.03 37.51 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.3 tp -100.14 116.53 32.37 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.684 -1.598 . . . . 0.0 107.602 177.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.412 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 49.2 p -110.1 145.39 37.22 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -105.82 91.05 3.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -82.15 178.83 53.43 Favored Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.19 -1.005 . . . . 0.0 111.032 179.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.517 ' C ' ' O ' ' A' ' 197' ' ' GLY . 54.5 m-20 9.55 -82.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.326 0.651 . . . . 0.0 112.51 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 47.5 t -143.08 4.11 1.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.527 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 70.4 p -119.89 -179.35 3.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.195 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.615 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.3 m95 -105.83 139.12 40.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.249 0.547 . . . . 0.0 111.341 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.449 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 32.7 m-70 -130.41 172.5 11.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.073 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.26 133.89 67.1 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.223 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 145' ' ' PHE . 2.9 p30 -151.96 170.96 18.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.662 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.48 ' O ' ' HD3' ' A' ' 190' ' ' ARG . . . -97.61 96.53 8.35 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -115.97 174.8 5.84 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.113 -177.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -83.57 11.11 7.6 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.051 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 23.1 mt-30 -117.63 135.76 53.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.441 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.505 ' NE2' HD13 ' A' ' 182' ' ' ILE . 93.0 mt-30 -65.56 175.23 1.89 Allowed 'General case' 0 CA--C 1.507 -0.673 0 CA-C-O 122.31 1.052 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 26.4 m -168.62 120.82 0.8 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 113.084 -1.871 . . . . 0.0 107.836 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 27.9 mt -74.88 129.11 37.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.077 0.465 . . . . 0.0 109.85 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.427 ' O ' ' HA ' ' A' ' 180' ' ' ASP . 98.0 m95 -116.06 146.74 41.95 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.632 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 45.7 t -113.7 101.77 9.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.133 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.716 HG22 ' HG ' ' A' ' 22' ' ' LEU . 79.3 t -92.88 101.78 12.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.779 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -112.84 140.3 23.87 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.2 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.423 ' HD3' HG13 ' A' ' 177' ' ' VAL . 24.0 Cg_exo -63.74 104.03 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 121.975 1.783 . . . . 0.0 110.984 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 62' ' ' LEU . 3.8 mm . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.383 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 176' ' ' ARG . 14.9 mm100 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.706 0.288 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -119.37 154.64 33.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.694 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 30.0 mt -82.51 121.67 27.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.442 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 7.7 mmm180 -109.26 157.16 19.1 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.012 0.434 . . . . 0.0 111.086 -179.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.402 ' C ' ' H ' ' A' ' 18' ' ' ASP . 7.6 p -68.27 156.63 37.28 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 72.45 -8.94 1.11 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.701 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.442 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 4.8 m-20 -67.91 135.35 52.33 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -82.0 118.05 22.69 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.504 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 18.2 m -134.83 172.62 15.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.666 ' HB ' ' SG ' ' A' ' 65' ' ' CYS . 4.6 m -134.91 139.31 47.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.2 176.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.796 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.5 mp -100.0 120.93 40.59 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.689 0.281 . . . . 0.0 110.662 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.46 ' OE1' HG21 ' A' ' 52' ' ' THR . 24.2 mt-30 -118.19 160.19 22.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.438 0.637 . . . . 0.0 111.793 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.6 p -146.76 143.61 28.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.319 179.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.1 m -88.04 121.59 30.63 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.054 0.454 . . . . 0.0 110.405 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.617 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -113.0 121.72 45.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.978 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 m -126.22 130.09 50.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.986 0.422 . . . . 0.0 111.86 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 16.8 tt -168.74 149.23 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.51 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 44.0 m80 59.28 39.32 22.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.11 23.67 13.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.386 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -127.77 147.17 50.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.455 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -131.75 148.78 52.6 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.967 0.413 . . . . 0.0 111.028 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 35' ' ' LEU . 3.6 pt20 -161.67 165.28 28.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.672 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HE3' ' HB3' ' A' ' 57' ' ' ASN . 37.9 mtmt -113.32 135.22 54.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.428 178.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 51' ' ' SER . 2.3 mt -124.69 142.33 51.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.728 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.601 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 47.6 t -106.36 145.58 31.51 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.4 . . . . 0.0 110.588 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 130' ' ' LEU . 33.4 tp -65.32 114.59 4.87 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.585 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.492 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -113.8 164.61 13.52 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.417 -179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.434 ' H ' ' HB ' ' A' ' 64' ' ' ILE . . . -169.02 161.1 10.4 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.594 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.67 144.17 51.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.724 179.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -76.8 -9.23 86.56 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.775 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -106.01 162.87 13.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.831 0.348 . . . . 0.0 111.146 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.97 -142.5 26.52 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.477 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 19.6 p30 -83.02 9.71 9.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.747 0.308 . . . . 0.0 110.833 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 44.47 29.29 0.38 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.177 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.2 mt -79.44 137.59 37.3 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.938 0.399 . . . . 0.0 110.487 179.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.4 m -77.91 153.89 32.17 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.634 0.73 . . . . 0.0 111.524 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -148.34 -166.11 2.45 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.319 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 37' ' ' LEU . 25.5 mt -130.44 143.89 51.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.299 0.571 . . . . 0.0 112.429 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 1.2 mt-10 -111.26 141.46 44.76 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.594 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.468 ' HA ' HD23 ' A' ' 35' ' ' LEU . 48.0 t -81.94 142.39 32.48 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.505 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 51.5 p -104.67 166.65 10.25 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.561 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 57' ' ' ASN . 17.7 m -53.69 -21.17 6.48 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.464 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.9 t30 64.25 113.3 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.68 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.458 ' HA ' ' HA ' ' A' ' 56' ' ' LYS . 80.8 p 46.87 74.92 0.13 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.774 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HE2' HG21 ' A' ' 58' ' ' VAL . 23.2 pttm -83.86 169.14 15.43 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 122.841 0.457 . . . . 0.0 110.481 -0.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.535 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 6.6 p-10 -58.16 -102.82 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.116 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.477 HG21 ' HE2' ' A' ' 56' ' ' LYS . 32.9 t 60.82 100.04 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.463 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -74.99 140.37 25.39 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.393 2.729 . . . . 0.0 111.451 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' A' ' 51' ' ' SER . 7.6 Cg_endo -51.24 -38.86 62.34 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.392 2.061 . . . . 0.0 111.459 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -120.59 81.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.676 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.575 HD11 HG11 ' A' ' 21' ' ' VAL . 45.2 tp -63.01 -30.33 71.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.541 -178.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 78.2 p -45.26 -56.63 4.66 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.492 HD12 ' HB1' ' A' ' 38' ' ' ALA . 30.4 pt -67.98 -18.24 23.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.666 ' SG ' ' HB ' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -95.59 -3.29 46.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.917 0.389 . . . . 0.0 111.679 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.459 HG22 ' OG ' ' A' ' 124' ' ' SER . 23.0 m -83.66 134.74 34.77 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -178.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -138.82 163.62 31.77 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.919 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 t -127.61 133.83 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.408 HD11 HG11 ' A' ' 20' ' ' VAL . 20.5 mt -82.45 65.33 7.53 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.488 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 11.8 mm-40 -45.22 -66.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -178.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.498 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 20.0 mm-40 -119.25 166.61 12.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.743 0.783 . . . . 0.0 113.1 -177.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.4 t -159.62 82.86 0.75 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.402 -1.272 . . . . 0.0 108.746 178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.41 HD13 ' SD ' ' A' ' 81' ' ' MET . 5.9 mt -111.6 157.11 20.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.388 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 47.8 t -69.13 150.04 47.99 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 41.3 t -52.88 -42.94 44.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.06 0.457 . . . . 0.0 110.18 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.7 ttp85 -59.24 -51.74 68.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.25 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -63.62 -41.15 98.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.721 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.81 -44.32 96.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.001 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -68.29 -34.03 75.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.911 0.386 . . . . 0.0 110.645 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -66.66 -41.57 87.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.704 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.431 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.3 mtt -64.31 -44.89 90.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.668 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 86' ' ' VAL . 82.2 mt -66.58 -34.76 78.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.796 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.16 75.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.049 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -74.4 -19.46 60.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.681 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 81' ' ' MET . 71.5 p -85.88 -12.11 51.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.764 0.316 . . . . 0.0 111.466 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 82' ' ' LEU . 20.4 t -78.03 -37.18 22.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.906 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -120.24 179.94 4.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -60.31 149.52 33.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.81 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.5 t -83.14 154.43 24.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.994 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -90.2 98.1 11.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.87 -12.61 8.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.473 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 59.9 101.4 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.832 0.349 . . . . 0.0 111.183 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 11.1 m -61.01 -40.43 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.288 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -94.28 85.27 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.366 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.7 t -84.23 -11.08 11.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.915 0.388 . . . . 0.0 111.516 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.759 ' HB2' ' H ' ' A' ' 100' ' ' PHE . 15.3 mm-40 -53.79 -44.17 69.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.644 -0.694 . . . . 0.0 112.74 -179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.725 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 46.9 mtmt -86.27 -49.81 7.42 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 0.0 110.881 -2.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.432 ' O ' ' HG2' ' A' ' 102' ' ' MET . 49.0 t90 -53.97 -43.66 70.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.651 -178.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.612 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 67.5 mttm -58.37 -30.3 66.68 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.153 -179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.759 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 9.8 t80 -73.87 -47.52 37.59 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.523 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 14.9 tpt -56.71 -38.62 72.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.603 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 98' ' ' TRP . 91.2 mmm -72.74 -43.37 63.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -57.45 -40.01 77.53 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.474 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 74.1 p -72.45 -46.83 53.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.919 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.97 -26.61 67.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -90.26 -32.07 16.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.894 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.62 -49.16 52.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.668 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -66.09 176.19 17.7 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.804 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.632 ' HA2' ' HB2' ' A' ' 110' ' ' HIS . . . -69.12 -173.79 9.54 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-O 119.413 -0.659 . . . . 0.0 112.618 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.632 ' HB2' ' HA2' ' A' ' 109' ' ' GLY . 45.5 m80 59.04 25.64 14.13 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.959 1.38 . . . . 0.0 111.93 -0.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -84.34 146.41 27.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.124 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 90.7 m -75.8 146.7 39.75 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.287 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.3 mp -81.2 131.68 35.31 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.768 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 117' ' ' HIS . 83.3 mt -116.04 141.98 47.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.244 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.58 129.13 39.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.451 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 102.16 -13.43 57.24 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.951 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 114' ' ' LEU . 0.3 OUTLIER -82.37 141.93 32.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.053 0.454 . . . . 0.0 111.303 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.74 125.22 31.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.3 pt -110.31 160.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.528 HD21 HG21 ' A' ' 153' ' ' THR . 20.0 tp -116.84 111.62 19.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.036 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.402 ' CD2' HD23 ' A' ' 69' ' ' LEU . 52.7 mt -98.82 117.69 33.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB2' ' HG3' ' A' ' 70' ' ' GLU . 17.2 ttp-105 -103.24 115.53 30.74 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.763 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.9 t-80 -58.18 108.19 0.57 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.459 ' OG ' HG22 ' A' ' 66' ' ' THR . 44.0 m -52.82 -46.27 67.65 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.504 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 60.4 t80 -63.33 -59.28 4.92 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 t -78.27 -17.0 57.24 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 76.67 -2.33 59.25 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.552 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 62.3 mtm -84.13 -167.11 1.63 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.463 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 63.5 m-85 -130.93 139.0 50.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -177.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 37' ' ' LEU . 30.3 tp -54.87 128.69 34.32 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 46.2 t -137.72 147.78 45.07 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -176.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 53.5 t -95.07 98.38 10.62 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.8 mt -75.33 153.43 37.86 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.618 -178.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 47.0 t -80.66 -4.59 54.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.769 -179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 32.4 p -83.95 122.01 28.16 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.728 0.299 . . . . 0.0 111.131 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 145' ' ' PHE . 50.8 m -69.28 -60.52 2.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -173.9 -57.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 52.6 m -134.31 -78.66 0.46 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.882 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.7 t -178.64 13.02 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.875 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 75.9 p -118.91 -11.78 9.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.46 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.24 150.71 37.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.246 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -143.39 -3.98 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.684 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.63 -66.48 0.51 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.365 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 206' ' ' ALA . . . -109.35 154.4 22.59 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.641 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.496 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 15.6 m-85 -101.61 172.22 7.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.143 178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -90.52 145.13 25.13 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 92.7 t -115.2 117.39 55.47 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.307 178.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.39 -149.58 5.84 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.87 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.427 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 68.0 mt -114.63 150.03 35.73 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.984 0.421 . . . . 0.0 110.852 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.494 HE22 ' CD2' ' A' ' 133' ' ' LEU . 2.4 tp-100 -137.4 139.34 40.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.775 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -68.63 -68.43 0.4 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.543 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -74.97 154.35 38.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.712 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.528 HG21 HD21 ' A' ' 120' ' ' LEU . 81.4 p -106.3 3.96 28.19 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.013 0.435 . . . . 0.0 111.096 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 74.9 p -59.15 114.12 2.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.312 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 125.35 -164.39 18.94 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.656 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.506 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 37.8 mt-10 -116.27 -13.8 11.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.676 0.274 . . . . 0.0 111.306 -179.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.34 65.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.209 -0.45 . . . . 0.0 112.198 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 30.0 p -88.83 6.67 37.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.632 0.253 . . . . 0.0 111.674 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -110.4 133.53 53.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.153 0.501 . . . . 0.0 111.347 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.445 ' O ' HG12 ' A' ' 119' ' ' ILE . 52.3 m95 -127.78 115.96 19.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.623 -179.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . . . . . . . . . 12.4 p -78.12 123.33 26.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.049 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.435 HD12 HG21 ' A' ' 175' ' ' VAL . 3.0 pt -85.89 136.93 21.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.99 0.424 . . . . 0.0 110.982 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -128.75 149.84 73.24 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.034 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.665 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 38.5 Cg_endo -66.71 137.79 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.449 2.1 . . . . 0.0 112.38 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 180' ' ' ASP . . . -75.61 -42.47 51.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.555 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 49.9 m -107.92 -169.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.459 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -91.64 -8.59 46.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.066 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -67.98 -38.31 82.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.047 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.665 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 5.6 mmp_? -88.59 150.84 22.85 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.824 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 60.4 m -133.28 167.83 19.67 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.881 0.372 . . . . 0.0 111.011 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.53 127.94 34.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.528 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.27 -14.72 63.28 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.086 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -70.53 155.98 40.01 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.031 0.443 . . . . 0.0 111.313 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 43.9 mttp -72.56 141.48 48.45 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.451 HG13 HD21 ' A' ' 181' ' ' LEU . 86.1 t -91.11 120.92 40.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.412 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.437 ' HA ' ' O ' ' A' ' 12' ' ' GLN . 18.8 mmt180 -84.8 153.81 22.74 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-O 121.156 0.503 . . . . 0.0 111.381 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.446 HG13 ' HD3' ' A' ' 216' ' ' PRO . 40.7 t -69.11 122.22 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 176.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 108.39 -14.77 35.98 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.399 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.33 127.13 31.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.747 0.308 . . . . 0.0 110.947 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 6.9 m-20 -68.52 110.06 4.02 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.451 HD21 HG13 ' A' ' 175' ' ' VAL . 69.4 mt -96.36 149.23 21.93 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.79 0.805 . . . . 0.0 112.924 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.06 112.51 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 8.9 mp -92.96 135.64 33.97 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.14 -178.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.465 HG22 ' CD1' ' A' ' 191' ' ' TYR . 84.9 t -127.75 127.75 68.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.75 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -64.43 127.86 33.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.506 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 93.8 t -71.22 -31.82 45.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.698 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 43.0 t -80.08 -36.65 35.22 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 60.4 p -116.74 2.4 12.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.1 OUTLIER 50.42 28.31 3.24 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 179.772 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 26.0 mtt180 -108.89 140.76 41.92 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.937 0.399 . . . . 0.0 110.99 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.478 ' O ' ' HA ' ' A' ' 205' ' ' ALA . 52.3 m-85 -72.03 153.77 41.55 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.42 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 28.5 tp -75.31 76.72 2.41 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 105.253 -2.129 . . . . 0.0 105.253 175.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -76.82 149.66 36.18 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 115.454 1.649 . . . . 0.0 115.454 -174.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 12.1 tp -99.0 115.02 27.97 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 113.78 -1.554 . . . . 0.0 107.622 177.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 47.0 t -107.83 146.54 32.11 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -177.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -106.0 91.89 3.92 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 198' ' ' ASN . . . -79.49 -175.07 47.05 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.36 -0.924 . . . . 0.0 111.507 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.533 ' C ' ' O ' ' A' ' 197' ' ' GLY . 79.6 m-20 -0.25 -78.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.379 0.671 . . . . 0.0 112.386 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 79.3 p -146.2 12.65 1.23 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.095 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 77.0 p -126.57 -178.54 4.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.868 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.617 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 93.6 m95 -107.81 136.3 47.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.145 0.498 . . . . 0.0 111.223 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.532 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 21.4 m-70 -129.15 173.27 10.63 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.949 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.45 131.27 71.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.204 179.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 53.6 p-10 -147.72 170.19 18.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.544 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -97.61 94.19 6.84 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 144' ' ' ALA . . . -112.79 176.5 4.99 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.788 -0.642 . . . . 0.0 112.09 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -85.32 7.96 20.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.1 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -114.43 136.37 53.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.733 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.81 174.52 1.82 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.45 1.119 . . . . 0.0 113.119 -178.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 24.8 m -168.61 119.86 0.78 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 112.886 -1.961 . . . . 0.0 107.72 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.569 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 48.7 mt -73.68 129.8 38.69 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.956 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 23' ' ' GLN . 98.1 m95 -116.89 138.5 51.49 Favored 'General case' 0 CA--C 1.505 -0.753 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.738 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 54.7 m -105.44 100.65 10.22 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.711 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.796 HG22 ' HG ' ' A' ' 22' ' ' LEU . 87.4 t -91.96 101.58 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.777 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -114.89 142.32 28.22 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.196 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.446 ' HD3' HG13 ' A' ' 177' ' ' VAL . 27.0 Cg_exo -62.76 104.97 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.18 1.92 . . . . 0.0 111.116 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.504 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 4.5 mm . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.24 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' NE2' ' HB ' ' A' ' 177' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 121.017 0.437 . . . . 0.0 111.365 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -116.66 156.07 27.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.545 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 23.3 mt -81.04 122.72 27.66 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.432 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 8.9 mmm180 -110.0 156.83 19.97 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.063 0.459 . . . . 0.0 111.093 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.5 p -68.2 155.33 39.88 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.753 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 71.97 -4.03 2.06 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.753 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD1' ' HB2' ' A' ' 15' ' ' ARG . 3.7 m-20 -72.46 134.43 45.33 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.623 179.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -81.26 120.98 25.59 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.473 ' HA ' ' H ' ' A' ' 217' ' ' ILE . 20.0 m -137.84 171.61 15.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -177.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.497 HG11 HD11 ' A' ' 62' ' ' LEU . 3.2 m -132.82 137.4 54.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.349 176.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HG ' HG22 ' A' ' 214' ' ' VAL . 7.6 mp -98.11 124.87 42.86 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.475 ' OE1' ' HB2' ' A' ' 57' ' ' ASN . 21.6 mt-30 -125.64 143.32 51.08 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 121.439 0.638 . . . . 0.0 112.339 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -128.89 144.08 51.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.851 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.0 m -86.61 120.58 28.08 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.134 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' A' ' 201' ' ' TRP . . . -111.19 121.25 44.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.258 -179.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 15.4 m -124.5 137.63 54.4 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.622 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.8 tt -177.64 146.16 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.581 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 47.8 m80 58.97 40.12 22.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.183 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt 60.64 22.03 11.9 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.283 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -126.46 138.4 53.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.452 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -126.65 147.63 49.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.974 0.416 . . . . 0.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -159.39 172.84 17.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.564 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 57' ' ' ASN . 27.7 mtmm -120.47 140.42 51.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.45 178.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.566 HD23 ' HA ' ' A' ' 51' ' ' SER . 1.4 mt -128.97 143.57 50.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.424 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 22' ' ' LEU . 27.9 p -106.96 138.33 43.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.014 0.435 . . . . 0.0 110.722 178.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.549 ' HA ' HD23 ' A' ' 49' ' ' LEU . 29.5 tp -60.08 111.04 1.36 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.091 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.455 ' HB1' HD12 ' A' ' 64' ' ' ILE . . . -111.39 165.68 11.76 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.599 -179.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.87 163.36 13.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.811 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -134.67 145.35 48.47 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.522 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.92 12.18 58.18 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.782 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -121.14 151.39 39.96 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.926 0.393 . . . . 0.0 110.808 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.9 -137.34 18.52 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.501 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.467 HD22 ' H ' ' A' ' 46' ' ' LEU . 0.3 OUTLIER -83.31 8.99 11.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.789 0.328 . . . . 0.0 110.893 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' HB2' ' HB2' ' A' ' 149' ' ' LEU . 0.0 OUTLIER 41.28 31.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.099 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.467 ' H ' HD22 ' A' ' 44' ' ' ASN . 39.5 mt -78.52 135.06 37.24 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 110.509 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 82.3 m -75.66 150.52 37.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.56 0.695 . . . . 0.0 111.297 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -144.03 -167.13 2.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 108.594 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.549 HD23 ' HA ' ' A' ' 37' ' ' LEU . 29.8 mt -131.87 142.82 49.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -178.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' LEU . 2.7 mt-10 -107.23 136.64 46.72 Favored 'General case' 0 CA--C 1.503 -0.856 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.794 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.566 ' HA ' HD23 ' A' ' 35' ' ' LEU . 76.7 p -79.84 134.01 36.3 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.537 ' HB ' ' C ' ' A' ' 57' ' ' ASN . 69.5 p -102.66 150.33 23.54 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.727 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.3 m -65.44 -7.51 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.545 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 65.64 130.65 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.741 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.685 ' N ' ' H ' ' A' ' 57' ' ' ASN . 38.0 t 57.96 85.2 0.09 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 41.0 ttmt -100.39 78.96 2.07 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.252 0.621 . . . . 0.0 111.146 -0.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.685 ' H ' ' N ' ' A' ' 55' ' ' SER . 3.8 p-10 39.12 36.44 0.18 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.073 179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.3 t -63.92 106.63 0.98 Allowed Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 57' ' ' ASN . 4.6 Cg_exo -79.99 140.46 14.29 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.784 2.323 . . . . 0.0 110.918 177.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -46.8 -40.16 24.59 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.543 2.162 . . . . 0.0 111.467 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.414 ' O ' HG12 ' A' ' 64' ' ' ILE . 12.9 t70 -130.93 92.34 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.592 179.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 HG11 ' A' ' 21' ' ' VAL . 48.3 tp -68.37 -29.14 67.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.031 -178.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.2 m -53.14 -48.74 67.68 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.455 HD12 ' HB1' ' A' ' 38' ' ' ALA . 26.3 pt -68.27 -17.68 22.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -179.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 61.2 m -99.92 13.75 32.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.873 0.368 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -92.01 130.97 37.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.567 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -137.7 159.12 42.84 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.259 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.562 HG21 ' NH2' ' A' ' 122' ' ' ARG . 2.9 t -123.51 133.68 68.48 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.606 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 18' ' ' ASP . 18.9 mt -81.72 64.77 6.57 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.511 ' HG3' ' HB2' ' A' ' 122' ' ' ARG . 9.5 mm-40 -44.13 -61.28 1.53 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -178.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.432 ' H ' ' HB3' ' A' ' 120' ' ' LEU . 10.6 mm100 -125.21 165.4 18.35 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.706 0.765 . . . . 0.0 112.889 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.2 t -157.82 85.67 0.9 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.935 179.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.2 mt -113.84 159.22 20.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.469 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.432 ' HB2' HH12 ' A' ' 76' ' ' ARG . 9.4 m -70.25 149.13 47.76 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 56.1 t -52.0 -45.05 40.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.004 0.43 . . . . 0.0 110.219 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.432 HH12 ' HB2' ' A' ' 74' ' ' SER . 1.9 tmm_? -57.37 -54.55 45.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.26 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 81' ' ' MET . . . -58.75 -44.96 90.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.909 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 15.6 tp -60.67 -47.17 87.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.444 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -65.67 -34.61 78.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.868 0.365 . . . . 0.0 110.669 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -66.27 -40.9 90.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.854 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 77' ' ' ALA . 68.1 mtt -63.86 -45.77 87.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.861 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.9 mt -67.59 -34.37 76.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.874 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.26 -34.04 75.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.952 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -69.51 -26.5 64.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.361 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 p -78.62 -12.89 60.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.742 0.306 . . . . 0.0 111.219 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 t -75.05 -51.12 22.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.042 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -99.61 120.62 39.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.813 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -96.37 135.36 38.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 77.0 p -161.52 178.38 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.765 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -75.75 147.66 39.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.05 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 106.61 -22.45 30.4 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.749 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 57.25 -168.68 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.71 0.29 . . . . 0.0 110.802 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.57 -37.11 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.912 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -85.47 77.34 9.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.001 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.492 ' C ' ' HA ' ' A' ' 97' ' ' LYS . 35.6 m -82.45 2.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.883 -178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.824 ' N ' ' HA ' ' A' ' 97' ' ' LYS . 2.2 mm-40 -53.76 -38.22 64.19 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.61 -0.71 . . . . 0.0 112.791 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.824 ' HA ' ' N ' ' A' ' 96' ' ' GLU . 56.2 mtpt -87.43 -51.85 5.7 Favored 'General case' 0 C--N 1.353 0.75 0 CA-C-N 120.324 1.42 . . . . 0.0 111.592 -3.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -66.31 -28.48 68.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.918 -1.492 . . . . 0.0 113.031 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.638 ' HB2' ' HB3' ' A' ' 96' ' ' GLU . 1.2 mptm? -60.29 -45.88 91.79 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 119.876 -0.729 . . . . 0.0 110.132 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . 0.659 ' H ' ' HB2' ' A' ' 96' ' ' GLU . 22.6 t80 -74.14 -41.95 60.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.261 179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -56.83 -46.35 81.75 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.982 0.42 . . . . 0.0 110.557 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 13.1 tmm? -71.04 -41.98 70.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.736 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -57.47 -40.39 78.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.745 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 49.2 p -73.05 -52.71 13.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.273 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.71 -27.45 62.97 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.459 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -85.52 -52.73 5.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.741 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -57.44 -62.02 6.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.532 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 53.65 -100.25 0.06 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.607 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -157.27 -170.76 22.52 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.336 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -84.61 -164.63 1.0 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 117.631 0.716 . . . . 0.0 110.819 -0.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -157.89 147.01 19.55 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.144 0.497 . . . . 0.0 111.5 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 98.0 m -79.56 146.74 32.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.16 131.92 35.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.826 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.9 mt -116.28 141.98 47.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.041 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -62.32 126.07 26.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.093 0.473 . . . . 0.0 110.59 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.48 -11.34 50.61 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.053 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 141.26 31.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.024 0.44 . . . . 0.0 111.259 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -82.06 126.97 32.61 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 160' ' ' TRP . 44.2 pt -112.05 160.27 11.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.564 0.697 . . . . 0.0 112.777 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 153' ' ' THR . 20.3 tp -115.78 110.38 19.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.053 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.405 ' CD2' HD23 ' A' ' 69' ' ' LEU . 61.9 mt -98.4 116.51 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.641 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.562 ' NH2' HG21 ' A' ' 68' ' ' VAL . 56.1 ttp85 -102.81 116.38 32.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.62 179.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' A' ' 125' ' ' TYR . 24.7 t-80 -59.37 106.54 0.46 Allowed 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 177.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 48.2 t -50.72 -45.65 58.64 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.454 ' HB3' ' CE1' ' A' ' 123' ' ' HIS . 37.5 t80 -65.27 -59.55 3.94 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.4 m -75.76 -16.42 60.13 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -178.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 75.42 -3.35 48.49 Favored Glycine 0 N--CA 1.454 -0.159 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.379 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 61.9 mtm -84.76 -166.25 1.42 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.486 ' HE2' ' HG3' ' A' ' 70' ' ' GLU . 62.1 m-85 -131.67 140.53 49.36 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -177.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.416 HD13 HD21 ' A' ' 37' ' ' LEU . 27.8 tp -55.23 129.55 38.75 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 177.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 40.0 t -138.69 149.26 44.94 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' CYS . . . . . . . . . . . . . 42.1 t -96.4 95.98 8.41 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 176.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 145' ' ' PHE . 13.4 mt -71.85 154.53 41.2 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.412 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 52.2 m -83.96 3.58 33.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.048 -178.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.1 p -90.8 127.19 36.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.717 0.294 . . . . 0.0 111.018 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 77.0 p -67.53 -60.36 2.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.846 0.355 . . . . 0.0 110.75 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -172.2 -78.08 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 56.6 p -127.25 -67.82 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.037 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -167.78 16.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.845 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 63.1 m -58.4 -77.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.145 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -160.18 -81.3 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.98 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -170.73 -92.96 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.203 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 143' ' ' LEU . 2.2 mm? 55.95 -85.73 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.436 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -107.31 150.7 26.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.154 0.502 . . . . 0.0 111.361 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.528 ' HB3' ' O ' ' A' ' 133' ' ' LEU . 12.4 m-85 -98.12 167.2 11.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.264 178.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -87.05 145.51 26.44 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.041 0.448 . . . . 0.0 109.96 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 89.7 t -115.06 116.56 52.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.536 178.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -135.51 -151.62 6.25 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.705 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . 55.5 mt -112.67 148.55 34.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.949 0.404 . . . . 0.0 110.737 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.19 40.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.87 -179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -66.5 -77.87 0.06 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.674 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -68.05 153.06 44.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 120' ' ' LEU . 73.2 p -104.3 4.02 33.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.099 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' THR . . . . . . . . . . . . . 73.4 p -56.2 115.46 2.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 122.67 -162.29 16.53 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.636 -0.792 . . . . 0.0 111.741 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.536 ' HB3' ' HB ' ' A' ' 186' ' ' VAL . 39.1 mt-10 -118.97 -9.96 9.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.707 0.289 . . . . 0.0 111.39 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.93 -31.13 68.39 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -91.18 8.1 37.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.583 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -111.6 133.09 54.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.458 . . . . 0.0 111.183 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' TRP . . . . . 0.469 ' O ' HG12 ' A' ' 119' ' ' ILE . 50.8 m95 -128.57 117.41 21.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.779 -178.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' THR . . . . . 0.436 ' OG1' ' HB ' ' A' ' 184' ' ' VAL . 10.7 p -79.2 125.99 30.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.136 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.508 HD12 HG21 ' A' ' 175' ' ' VAL . 3.2 pt -87.69 136.41 23.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.928 0.394 . . . . 0.0 110.938 -179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -128.6 150.94 76.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.087 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.716 ' HB3' ' HB2' ' A' ' 169' ' ' ARG . 42.0 Cg_endo -67.84 140.92 52.26 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.488 2.125 . . . . 0.0 112.286 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -72.87 -46.22 54.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.809 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.457 ' HB2' ' HG2' ' A' ' 168' ' ' GLN . 58.9 m -112.92 -171.09 1.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.44 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' LYS . . . . . 0.483 ' HG3' ' NE2' ' A' ' 168' ' ' GLN . 0.0 OUTLIER -88.51 8.27 28.9 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.235 -179.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.483 ' NE2' ' HG3' ' A' ' 167' ' ' LYS . 8.7 mm-40 -81.36 -37.8 27.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.059 0.457 . . . . 0.0 110.567 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.716 ' HB2' ' HB3' ' A' ' 164' ' ' PRO . 78.4 mmt-85 -91.82 150.46 21.06 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.402 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 44.9 t -128.46 166.53 18.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.136 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.99 128.54 36.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.309 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 98.3 -16.39 60.03 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.877 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -69.1 156.38 38.77 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 120.929 0.395 . . . . 0.0 111.201 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -72.95 143.48 47.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.508 HG21 HD12 ' A' ' 162' ' ' ILE . 93.0 t -93.43 118.89 40.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.458 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ARG . . . . . 0.422 HH11 ' N ' ' A' ' 12' ' ' GLN . 26.8 mmt180 -83.39 155.34 23.54 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.322 0.582 . . . . 0.0 111.563 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' VAL . . . . . 0.429 ' HB ' ' NE2' ' A' ' 12' ' ' GLN . 30.7 t -69.46 120.95 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' GLY . . . . . . . . . . . . . . . 109.24 -15.13 33.19 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.472 -0.871 . . . . 0.0 112.379 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -65.68 128.76 37.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.697 0.284 . . . . 0.0 110.732 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . 0.451 ' HB3' ' HB3' ' A' ' 211' ' ' LEU . 3.9 m-20 -69.76 111.17 5.34 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 175' ' ' VAL . 76.8 mt -97.27 148.73 22.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -178.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 55.6 mt -114.65 112.02 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 191' ' ' TYR . 9.4 mp -91.89 138.24 31.71 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.141 0.496 . . . . 0.0 112.108 -178.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' VAL . . . . . 0.495 HG22 ' CD1' ' A' ' 191' ' ' TYR . 88.9 t -129.15 128.21 66.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.797 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 8.9 m -65.48 127.36 31.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 156' ' ' GLU . 87.8 t -71.93 -33.35 47.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.637 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' SER . . . . . . . . . . . . . 92.7 p -80.42 -36.02 34.29 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' A' ' 189' ' ' GLU . 63.2 m -114.83 2.41 14.35 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 188' ' ' SER . 0.3 OUTLIER 49.31 29.02 2.53 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 205' ' ' ALA . 32.3 mtt180 -111.63 140.19 46.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 110.87 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' TYR . . . . . 0.495 ' CD1' HG22 ' A' ' 184' ' ' VAL . 52.0 m-85 -71.11 155.12 41.14 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . 0.409 ' O ' ' NE1' ' A' ' 212' ' ' TRP . 29.7 tp -75.52 75.83 2.56 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 175.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 208' ' ' GLN . 81.4 t60 -75.46 150.09 38.33 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -174.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 13.5 tp -100.21 112.6 24.93 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 113.649 -1.614 . . . . 0.0 107.639 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' SER . . . . . 0.407 ' OG ' ' HB2' ' A' ' 202' ' ' HIS . 62.9 p -105.0 145.69 30.08 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -177.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -105.23 91.36 3.76 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' GLY . . . . . 0.572 ' H ' ' HD2' ' A' ' 202' ' ' HIS . . . -78.69 -174.49 44.6 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.511 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.532 ' C ' ' O ' ' A' ' 197' ' ' GLY . 11.9 m-80 -0.42 -78.92 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.302 0.641 . . . . 0.0 112.366 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' SER . . . . . . . . . . . . . 50.4 m -146.93 13.19 1.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.927 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 73.8 p -126.61 -177.81 4.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.917 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' TRP . . . . . 0.643 ' CE2' ' HB1' ' A' ' 26' ' ' ALA . 94.6 m95 -108.56 135.09 50.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.314 0.578 . . . . 0.0 111.341 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' HIS . . . . . 0.572 ' HD2' ' H ' ' A' ' 197' ' ' GLY . 18.4 m-70 -128.33 174.11 9.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.892 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 6.4 p -126.78 132.14 70.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' ASP . . . . . . . . . . . . . 52.0 p-10 -150.09 167.11 27.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.715 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.486 ' HA ' ' O ' ' A' ' 191' ' ' TYR . . . -94.32 95.27 8.79 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . . . . . . . . . . . -115.32 173.64 6.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.339 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -81.55 8.01 10.69 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' GLN . . . . . 0.473 ' HB2' ' CE1' ' A' ' 193' ' ' HIS . 74.9 mm-40 -114.67 137.42 51.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.731 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 209' ' ' GLN . . . . . 0.403 HE21 ' HB2' ' A' ' 209' ' ' GLN . 20.1 mt-30 -66.13 174.82 2.36 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-O 122.279 1.038 . . . . 0.0 112.809 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 210' ' ' THR . . . . . . . . . . . . . 27.0 m -168.01 121.02 0.89 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.186 -1.824 . . . . 0.0 107.945 178.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 211' ' ' LEU . . . . . 0.451 ' HB3' ' HB3' ' A' ' 180' ' ' ASP . 68.4 mt -75.37 128.06 34.53 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.98 0.419 . . . . 0.0 109.967 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 212' ' ' TRP . . . . . 0.409 ' NE1' ' O ' ' A' ' 192' ' ' LEU . 98.1 m95 -115.64 145.77 42.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 48.9 m -114.01 102.36 10.11 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.206 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 214' ' ' VAL . . . . . 0.747 HG22 ' HG ' ' A' ' 22' ' ' LEU . 80.4 t -93.39 105.55 16.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.041 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 216' ' ' PRO . . . -116.69 141.4 28.07 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.247 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 216' ' ' PRO . . . . . 0.466 ' O ' HG12 ' A' ' 217' ' ' ILE . 23.5 Cg_exo -64.31 104.73 0.53 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.194 1.929 . . . . 0.0 111.192 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.473 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 1.7 mm . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.986 -179.346 . . . . . . . . 1 1 . 1 stop_ save_