data_2llq_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 2llq _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 120.712 0.291 . . . . 2.61 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -33.72 72.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 1.78 111.481 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.6 mt -68.21 -43.09 85.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.013 0.435 . . . . 1.72 110.319 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -64.91 -47.63 77.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.661 -0.7 . . . . 2.53 110.488 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -68.73 -30.01 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.916 -0.583 . . . . 1.91 110.882 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.34 82.62 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.479 -0.328 . . . . 1.14 110.676 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.5 -38.96 75.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.034 0.445 . . . . 1.11 110.329 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -70.73 -35.5 72.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.911 -0.586 . . . . 2.28 110.526 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.464 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 98.2 t -72.49 -35.18 50.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.092 -0.504 . . . . 1.36 110.76 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -73.45 -39.05 65.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 1.31 110.09 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.7 103.87 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.646 -0.706 . . . . 0.95 110.776 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.464 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 2.5 mptt -94.63 -28.66 15.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.443 -0.344 . . . . 1.65 111.563 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.426 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -77.32 -21.81 52.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.841 0.353 . . . . 1.36 111.028 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.7 57.55 4.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.032 -0.604 . . . . 1.08 113.391 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 19.8 p-10 -125.88 -1.11 7.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.046 0.451 . . . . 0.95 110.413 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.94 23.96 73.26 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.946 -0.645 . . . . 0.71 112.231 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.429 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 42.2 m-85 -142.8 139.46 30.97 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.188 0.518 . . . . 1.44 111.102 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.519 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 66.7 mt -93.03 99.34 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.113 -0.949 . . . . 1.18 109.705 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.2 t -81.9 163.87 21.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.899 -0.592 . . . . 1.48 110.126 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.38 90.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.86 110.818 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -32.88 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 1.01 110.993 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -74.49 -41.18 61.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.054 -0.521 . . . . 0.88 110.436 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.718 HD22 ' CH2' ' B' ' 292' ' ' TRP . 10.9 tp -65.52 -29.91 70.61 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.392 -0.367 . . . . 0.97 110.124 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -57.0 -56.34 23.06 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.149 -0.478 . . . . 2.51 110.107 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -58.08 -35.55 71.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.864 0.364 . . . . 1.44 111.472 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.77 -56.97 10.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.3 -0.409 . . . . 1.04 111.743 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.558 ' CE ' ' HA ' ' B' ' 292' ' ' TRP . 0.8 OUTLIER -72.5 -19.73 61.48 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.114 0.783 . . . . 1.88 113.114 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.7 p -78.64 -41.79 30.52 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.122 -0.631 . . . . 2.02 110.551 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -67.33 -23.11 65.59 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.378 0.609 . . . . 2.2 109.944 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.51 -35.51 74.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.019 -0.991 . . . . 1.67 110.337 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.01 -65.38 0.56 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.667 -0.778 . . . . 1.25 112.211 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -74.9 90.19 2.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.14 0.495 . . . . 2.09 110.75 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -83.02 104.97 13.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 2.24 110.681 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 83.3 mt -91.71 175.4 6.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.11 -0.495 . . . . 1.64 110.23 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.419 ' O ' HG22 ' A' ' 121' ' ' VAL . 40.6 p -76.5 166.34 23.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.703 0.287 . . . . 1.25 111.368 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.46 -37.87 70.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 1.99 110.685 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.28 -44.17 95.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.048 -0.524 . . . . 2.75 110.575 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 124' ' ' MET . 37.8 mt-10 -67.9 -37.31 81.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 1.14 110.336 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' A' ' 124' ' ' MET . 97.6 t -64.98 -41.45 92.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 N-CA-C 109.04 -0.726 . . . . 1.34 109.04 177.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.482 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.4 t70 -65.69 -44.26 86.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.87 -0.789 . . . . 1.38 108.87 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 127' ' ' GLU . 19.9 tt0 -53.01 -41.58 64.78 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.446 -0.797 . . . . 1.94 109.704 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' B' ' 292' ' ' TRP . 57.3 mtp -54.47 -51.0 66.41 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.07 -0.968 . . . . 1.08 110.852 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.469 ' HA ' ' HB2' ' A' ' 128' ' ' ALA . 0.2 OUTLIER -76.49 -22.49 15.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.251 -0.58 . . . . 1.33 111.002 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 59.3 mtm-85 -65.33 -37.08 85.99 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.35 -0.611 . . . . 1.97 109.35 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.533 ' OE1' ' HB1' ' B' ' 289' ' ' ALA . 12.8 pt-20 -92.41 -1.99 56.63 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 1.55 109.988 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.469 ' HB2' ' HA ' ' A' ' 125' ' ' ILE . . . -107.55 5.38 26.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.511 0.672 . . . . 0.82 109.682 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.66 125.51 52.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.11 -0.95 . . . . 0.8 109.708 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.72 -27.12 2.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.186 -0.461 . . . . 1.45 110.791 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.52 -10.34 59.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.282 -0.417 . . . . 1.35 111.072 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.48 62.51 3.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.745 -0.74 . . . . 1.25 112.426 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.1 -17.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.649 0.261 . . . . 1.13 110.81 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.93 -14.92 63.97 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.901 -0.666 . . . . 0.99 113.298 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -119.26 169.21 10.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 1.27 110.632 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.646 HG11 ' CH2' ' B' ' 292' ' ' TRP . 27.0 m -106.09 113.7 43.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.142 0.496 . . . . 1.81 109.87 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.506 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 25.4 p30 -92.21 -177.63 4.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.349 -0.612 . . . . 0.96 109.349 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.92 -57.04 12.45 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.986 0.365 . . . . 1.51 111.986 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -57.45 -46.95 83.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 1.84 111.766 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.506 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 32.7 mt-10 -61.79 -42.92 99.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.795 0.331 . . . . 0.74 110.511 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.15 -45.39 91.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.774 -0.648 . . . . 1.04 110.114 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 70.3 t -64.29 -49.94 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.427 -0.806 . . . . 1.36 111.689 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.69 -38.6 87.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.437 0.532 . . . . 2.28 112.437 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.477 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -70.4 -41.69 72.65 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.746 -0.382 . . . . 1.21 111.589 -179.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.503 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -74.99 -45.92 38.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.016 0.436 . . . . 1.48 111.006 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.43 77.88 1.68 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.205 -0.452 . . . . 1.73 110.749 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -91.72 126.77 36.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.123 -0.49 . . . . 1.64 110.721 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.24 -0.886 . . . . 3.71 109.784 179.775 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 109.072 -0.714 . . . . 2.52 109.072 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.42 ' HB1' ' HG2' ' A' ' 124' ' ' MET . . . -97.77 0.68 47.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.55 -0.75 . . . . 1.96 112.763 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . 0.533 ' HB1' ' OE1' ' A' ' 127' ' ' GLU . . . -32.23 -50.29 0.22 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.328 0.862 . . . . 1.33 113.328 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.524 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.9 p-10 -59.94 -24.29 64.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.64 0.257 . . . . 1.17 111.437 -179.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.591 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.3 tp -69.52 -25.17 63.9 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 109.332 -0.618 . . . . 2.08 109.332 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.718 ' CH2' HD22 ' A' ' 105' ' ' LEU . 53.5 m95 -60.88 -56.96 29.93 Favored Pre-proline 0 C--O 1.249 1.045 0 N-CA-C 106.976 -1.49 . . . . 0.51 106.976 176.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 50.2 Cg_exo -59.17 -17.85 41.08 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 121.268 1.312 . . . . 0.76 112.276 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.591 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 43.4 m -56.7 -64.73 2.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-O 118.288 -0.863 . . . . 0.79 110.923 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.558 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.4 Cg_exo -62.24 -26.49 77.53 Favored 'Trans proline' 0 C--N 1.372 1.79 0 CA-C-N 121.889 1.71 . . . . 0.85 110.62 176.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.8 tp -62.12 -44.42 96.67 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.583 0.706 . . . . 1.42 109.158 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 34.1 ttm -67.45 -32.88 74.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 1.82 108.923 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.507 HG12 ' O ' ' B' ' 294' ' ' SER . 40.7 mm -65.55 -32.48 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.211 -0.904 . . . . 0.84 109.191 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -45.18 94.46 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.89 -0.781 . . . . 1.89 108.89 177.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -66.68 -35.22 79.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.828 -0.624 . . . . 2.86 109.604 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 49.0 m -69.42 -36.74 76.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 1.02 109.736 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -66.98 -31.22 71.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 2.62 109.42 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -66.43 -42.48 87.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.691 -0.855 . . . . 2.21 108.691 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.43 -41.43 84.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.306 -0.861 . . . . 2.06 109.207 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 2.05 109.53 178.656 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 CA--C 1.527 0.092 0 N-CA-C 112.659 0.614 . . . . 2.61 112.659 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -63.14 -28.29 69.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 111.787 0.291 . . . . 1.78 111.787 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -64.94 -48.0 85.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.23 0.538 . . . . 1.72 109.667 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -70.6 -44.53 67.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.568 -0.742 . . . . 2.53 110.121 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.404 ' O ' HG23 ' A' ' 91' ' ' VAL . 42.1 mm-40 -61.02 -43.1 99.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.827 -0.624 . . . . 1.91 111.173 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.99 79.5 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.14 110.119 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -56.81 -41.37 77.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.627 -0.715 . . . . 1.11 110.64 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -68.13 -36.22 79.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.834 -0.621 . . . . 2.28 111.571 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.535 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 94.3 t -77.88 -35.83 21.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.821 0.343 . . . . 1.36 111.016 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -71.42 -33.14 69.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.504 -0.316 . . . . 1.31 110.813 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -82.9 90.01 6.91 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.607 -0.516 . . . . 0.95 109.607 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 4.6 mptt -91.64 -18.9 23.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 1.65 111.714 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.437 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER -79.46 -23.92 42.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.874 -0.33 . . . . 1.36 110.549 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.5 58.1 3.69 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.845 -0.693 . . . . 1.08 113.127 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.437 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 19.9 p-10 -126.67 -5.62 6.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.867 0.365 . . . . 0.95 110.295 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.96 17.15 77.67 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.847 -0.615 . . . . 0.71 112.751 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -143.89 139.11 29.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.703 0.287 . . . . 1.44 110.577 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.542 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 9.8 mt -84.76 103.12 11.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.541 -0.911 . . . . 1.18 108.541 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.485 ' HA ' ' HG2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -82.58 164.02 21.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.655 -0.702 . . . . 1.48 110.367 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -56.46 -44.41 80.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.86 111.044 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -41.33 96.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.045 0.45 . . . . 1.01 110.739 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.434 ' O ' HG22 ' A' ' 108' ' ' VAL . 47.7 mt-10 -67.49 -41.77 83.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.745 -0.662 . . . . 0.88 110.469 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.737 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 16.3 tp -67.31 -32.33 73.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.287 -0.415 . . . . 0.97 110.245 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.48 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 30.3 mtm-85 -57.97 -39.44 78.16 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.638 -0.504 . . . . 2.51 109.638 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -71.31 -33.48 69.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.519 . . . . 1.44 110.106 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.434 HG22 ' O ' ' A' ' 104' ' ' GLU . 96.0 t -62.15 -49.15 85.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.09 -0.505 . . . . 1.04 110.07 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.499 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.2 OUTLIER -66.26 -34.0 77.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 1.88 110.683 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.2 m -64.19 -45.72 87.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.912 0.386 . . . . 2.02 110.22 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -73.98 -24.25 59.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 2.2 110.26 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.8 tp -63.69 -31.77 73.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.673 -0.694 . . . . 1.67 110.302 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.01 -40.17 2.61 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.786 -0.721 . . . . 1.25 112.071 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.68 98.0 5.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 2.09 110.474 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -89.14 100.52 13.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 2.24 110.337 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.84 -174.29 2.5 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.818 -0.628 . . . . 1.64 110.824 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 43.8 p -78.19 165.17 24.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 1.25 110.722 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.48 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 18.9 t70 -63.79 -37.63 88.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.326 -0.397 . . . . 1.99 110.737 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -66.0 -31.85 72.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.134 -0.484 . . . . 2.75 110.386 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -67.38 -37.95 83.95 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.157 -0.683 . . . . 1.14 109.157 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.457 ' O ' ' HB2' ' A' ' 124' ' ' MET . 58.6 t -67.72 -36.33 75.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.638 -0.875 . . . . 1.34 108.638 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -65.87 -43.3 88.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.197 -0.91 . . . . 1.38 108.896 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -57.7 -38.84 75.89 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.802 -0.814 . . . . 1.94 108.802 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.705 ' SD ' HD22 ' B' ' 291' ' ' LEU . 38.8 mtp -58.18 -52.27 66.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.177 -0.92 . . . . 1.08 111.276 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.5 mm -68.67 -34.86 67.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 120.753 -0.379 . . . . 1.33 110.485 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -64.38 -29.65 70.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.947 0.403 . . . . 1.97 110.121 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.14 -27.08 24.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.531 -0.759 . . . . 1.55 110.664 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -89.31 -26.12 21.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.061 -0.518 . . . . 0.82 112.027 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -90.59 109.71 20.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.981 0.419 . . . . 0.8 109.967 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 6.1 mt -100.68 -31.43 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.875 -0.602 . . . . 1.45 111.134 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.56 -20.16 58.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.773 0.321 . . . . 1.35 111.447 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.84 61.87 2.33 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.666 -0.778 . . . . 1.25 113.005 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -121.72 -14.11 8.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.858 0.361 . . . . 1.13 110.269 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.67 -11.41 61.11 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.076 -0.583 . . . . 0.99 112.632 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.485 ' HG2' ' HA ' ' A' ' 101' ' ' SER . 16.5 mt-30 -132.29 165.35 24.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.329 0.585 . . . . 1.27 110.853 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.602 HG11 ' CH2' ' B' ' 292' ' ' TRP . 4.6 m -106.8 124.9 62.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.79 -0.819 . . . . 1.81 108.79 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.557 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.8 p30 -103.54 -178.46 3.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.442 -0.345 . . . . 0.96 110.348 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.447 ' O ' HG21 ' A' ' 142' ' ' VAL . 68.9 t80 -59.2 -44.18 92.23 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 111.914 0.339 . . . . 1.51 111.914 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -61.97 -46.08 90.85 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.698 0.285 . . . . 1.84 111.524 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.557 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 31.7 mt-10 -72.29 -32.24 66.43 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.123 0.487 . . . . 0.74 110.384 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.508 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 10.3 t80 -58.89 -52.73 64.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.351 -0.84 . . . . 1.04 111.56 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 138' ' ' TYR . 44.7 t -60.82 -36.48 71.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.488 . . . . 1.36 111.463 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.0 -25.76 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.41 . . . . 2.28 111.912 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.53 ' HE3' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -73.15 -56.46 5.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.075 0.464 . . . . 1.21 110.901 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.42 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 2.0 mpt? -68.46 -53.29 24.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.814 -0.63 . . . . 1.48 111.244 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 73.77 10.02 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.931 0.396 . . . . 1.73 110.956 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 65.98 6.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 1.64 110.908 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 41.0 mmtt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.697 -0.668 . . . . 3.71 110.287 -179.971 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 287' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 109.906 -0.405 . . . . 2.52 109.906 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.676 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -111.17 -28.76 8.14 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.861 0.689 . . . . 1.96 112.861 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.39 -33.95 9.99 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 1.33 112.54 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 21.5 p-10 -92.1 -30.68 15.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 111.967 0.358 . . . . 1.17 111.967 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.752 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 6.1 tp -72.79 -41.71 64.71 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 113.426 0.899 . . . . 2.08 113.426 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.737 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 77.0 m95 -56.61 -50.87 85.36 Favored Pre-proline 0 C--O 1.247 0.954 0 CA-C-N 119.918 1.236 . . . . 0.51 108.989 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 44.6 Cg_exo -60.53 -21.71 69.44 Favored 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 121.591 1.527 . . . . 0.76 111.877 176.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 66.6 m -55.84 -65.27 1.6 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-O 118.523 -0.751 . . . . 0.79 110.809 179.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.752 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 13.5 Cg_endo -60.02 -31.21 93.17 Favored 'Trans proline' 0 C--N 1.368 1.589 0 CA-C-N 121.345 1.516 . . . . 0.85 111.665 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -44.79 88.8 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.004 -0.678 . . . . 1.42 109.926 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 43.4 ttm -69.39 -35.37 75.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.115 -0.698 . . . . 1.82 109.115 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 22.8 mm -65.62 -30.49 50.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.333 -0.849 . . . . 0.84 109.118 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -68.08 -39.03 82.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.076 -0.713 . . . . 1.89 109.076 178.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -65.17 -36.63 84.81 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.264 -1.013 . . . . 2.86 108.264 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 10.9 m -71.55 -32.63 68.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.013 -0.994 . . . . 1.02 109.291 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -69.2 -38.62 78.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.464 -0.939 . . . . 2.62 108.464 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -60.27 -42.43 95.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.307 -0.998 . . . . 2.21 108.307 177.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -62.54 -41.22 98.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.922 -1.035 . . . . 2.06 109.086 177.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.292 -0.867 . . . . 2.05 110.263 179.405 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.082 0 CA-C-O 120.505 0.193 . . . . 2.61 111.495 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.46 -31.86 68.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.531 -0.304 . . . . 1.78 111.548 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -66.36 -42.7 91.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.923 0.392 . . . . 1.72 110.479 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -65.1 -41.09 95.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.395 0.617 . . . . 2.53 109.433 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -68.02 -39.85 83.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.691 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.44 -41.84 77.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.49 . . . . 1.14 111.024 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -57.77 -38.76 75.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.072 -0.513 . . . . 1.11 110.818 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -74.71 -40.02 61.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.183 -0.462 . . . . 2.28 111.006 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.25 -36.94 78.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 1.36 111.052 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -73.72 -40.03 63.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.41 . . . . 1.31 110.192 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.508 ' HA ' ' OE2' ' A' ' 104' ' ' GLU . 31.0 t70 -81.98 75.55 8.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.415 0.626 . . . . 0.95 110.175 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -77.74 -21.62 51.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.394 -0.821 . . . . 1.65 111.225 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.97 -13.05 60.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.566 -0.288 . . . . 1.36 110.786 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 63.5 63.95 4.1 Favored Glycine 0 C--N 1.333 0.363 0 CA-C-N 115.925 -0.579 . . . . 1.08 112.962 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.571 HD22 ' HB2' ' A' ' 99' ' ' TYR . 0.4 OUTLIER -132.57 -8.62 3.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.871 0.367 . . . . 0.95 110.528 -179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.71 15.75 74.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.14 -0.552 . . . . 0.71 113.937 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.571 ' HB2' HD22 ' A' ' 97' ' ' ASN . 94.5 m-85 -144.76 133.62 22.45 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.422 0.611 . . . . 1.44 110.929 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.407 HD13 HG23 ' A' ' 100' ' ' ILE . 33.6 mt -81.99 112.58 20.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.839 -0.618 . . . . 1.18 109.62 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.5 p -95.67 172.97 7.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 1.48 110.166 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.88 92.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.659 0.266 . . . . 0.86 110.298 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.03 76.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 1.01 111.092 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.508 ' OE2' ' HA ' ' A' ' 93' ' ' ASP . 49.1 mt-10 -63.01 -36.83 84.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.987 -0.551 . . . . 0.88 111.166 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.726 HD23 ' CZ2' ' B' ' 292' ' ' TRP . 7.0 tp -76.73 -34.54 58.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.643 -0.253 . . . . 0.97 111.02 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.402 ' NE ' HG13 ' A' ' 121' ' ' VAL . 36.1 mtt180 -58.81 -37.31 76.12 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.705 -0.48 . . . . 2.51 109.705 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.0 -23.05 65.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.493 -0.776 . . . . 1.44 110.62 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.6 t -83.04 -47.35 18.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.929 -0.578 . . . . 1.04 110.564 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.6 mmt -66.27 -30.42 70.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.81 -0.632 . . . . 1.88 112.091 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -41.5 86.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.043 0.449 . . . . 2.02 110.247 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.77 -27.76 62.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.763 -0.653 . . . . 2.2 109.555 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.4 tp -63.3 -39.49 94.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.309 -0.859 . . . . 1.67 109.703 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.88 -31.16 4.85 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.63 -0.714 . . . . 1.25 111.608 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.0 93.07 7.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.373 0.606 . . . . 2.09 110.695 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -87.86 95.83 10.25 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.516 -0.766 . . . . 2.24 109.336 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.92 163.57 17.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.964 -0.562 . . . . 1.64 111.148 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.464 ' O ' HG22 ' A' ' 121' ' ' VAL . 41.7 p -81.24 169.35 17.43 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.836 -0.62 . . . . 1.25 110.05 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -36.03 70.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.875 0.369 . . . . 1.99 110.969 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.0 -46.72 76.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 2.75 110.421 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.03 -37.36 83.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.891 -0.595 . . . . 1.14 110.636 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 117' ' ' THR . 69.6 t -63.23 -32.25 55.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.954 0.407 . . . . 1.34 110.0 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.5 -53.0 61.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.028 -0.533 . . . . 1.38 109.784 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 126' ' ' ARG . 19.6 tt0 -67.75 -26.79 66.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.091 -0.504 . . . . 1.94 110.059 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.807 ' HE3' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -52.87 -53.76 44.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.712 -0.676 . . . . 1.08 110.746 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.441 HG22 ' O ' ' A' ' 125' ' ' ILE . 1.1 mt -89.36 -18.98 7.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.363 -0.535 . . . . 1.33 110.586 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.419 ' HB3' ' HA ' ' A' ' 123' ' ' GLU . 14.2 ttm180 -65.16 -35.47 81.2 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 108.916 -0.772 . . . . 1.97 108.916 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.406 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 7.0 tt0 -74.42 -16.32 60.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.952 -1.022 . . . . 1.55 109.19 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.63 31.81 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.19 -0.913 . . . . 0.82 110.594 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -112.36 112.95 24.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.401 0.619 . . . . 0.8 110.331 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mt -106.11 -36.78 3.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.358 -0.837 . . . . 1.45 110.817 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.42 -29.99 64.22 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.749 0.277 . . . . 1.35 111.749 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 93.46 21.95 27.98 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.543 -0.837 . . . . 1.25 112.367 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.57 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 1.6 p-10 -89.11 -9.32 51.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.903 0.383 . . . . 1.13 110.716 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.69 -2.74 85.29 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.955 -0.64 . . . . 0.99 112.944 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.57 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 12.6 mt-30 -120.38 169.76 10.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.959 0.409 . . . . 1.27 110.284 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.647 HG22 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -116.12 105.29 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.466 -0.788 . . . . 1.81 109.309 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.571 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.6 p30 -95.73 175.71 6.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.808 -0.633 . . . . 0.96 109.958 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.447 ' O ' HG21 ' A' ' 142' ' ' VAL . 50.2 t80 -51.61 -45.33 63.17 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.467 0.479 . . . . 1.51 111.624 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.79 -50.4 74.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.707 -0.679 . . . . 1.84 112.028 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.571 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 23.6 mt-10 -72.74 -32.8 65.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.076 0.465 . . . . 0.74 111.197 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.8 -53.17 59.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 1.04 112.085 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 138' ' ' TYR . 61.9 t -61.23 -40.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 111.961 0.356 . . . . 1.36 111.961 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -67.47 -28.44 67.86 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.197 -0.201 . . . . 2.28 111.485 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.406 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -64.2 -48.94 73.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.142 0.496 . . . . 1.21 110.907 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.436 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 1.9 mpt? -77.27 -36.42 54.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.952 -0.567 . . . . 1.48 111.25 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.7 55.92 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.235 0.541 . . . . 1.73 110.554 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.18 127.89 32.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.478 -0.783 . . . . 1.64 110.605 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.945 -0.57 . . . . 3.71 110.128 179.743 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 110.197 -0.297 . . . . 2.52 110.197 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.486 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -90.23 -30.56 17.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.905 0.383 . . . . 1.96 110.532 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -49.21 -39.0 28.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.202 -0.908 . . . . 1.33 112.686 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.44 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.0 p-10 -88.5 -22.96 23.36 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.013 0.375 . . . . 1.17 112.013 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' B' ' 294' ' ' SER . 6.9 tp -73.57 -43.27 60.23 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 118.739 -0.648 . . . . 2.08 111.878 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.807 ' CD1' ' HE3' ' A' ' 124' ' ' MET . 66.6 m95 -52.96 -52.47 64.89 Favored Pre-proline 0 CA--C 1.552 1.044 0 CA-C-N 119.262 0.937 . . . . 0.51 109.663 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 41.4 Cg_exo -60.33 -23.16 73.65 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.861 1.708 . . . . 0.76 112.028 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.544 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.9 m -55.93 -64.79 1.93 Allowed Pre-proline 0 CA--C 1.546 0.821 0 CA-C-O 118.355 -0.831 . . . . 0.79 110.834 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 51.5 Cg_exo -57.85 -31.74 93.22 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 121.572 1.597 . . . . 0.85 111.561 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.15 -46.16 91.69 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.195 0.522 . . . . 1.42 109.681 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 51.0 ttm -66.99 -39.1 87.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.799 -0.637 . . . . 1.82 109.47 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.51 HG12 ' O ' ' B' ' 294' ' ' SER . 30.7 mm -61.73 -32.43 53.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.734 . . . . 0.84 109.944 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -66.85 -45.97 76.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.06 -0.518 . . . . 1.89 110.246 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.82 -34.22 77.66 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.458 -0.571 . . . . 2.86 109.458 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 15.3 m -70.73 -34.78 72.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.573 -0.739 . . . . 1.02 109.197 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -69.98 -34.89 73.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.183 -0.673 . . . . 2.62 109.183 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -63.33 -40.08 96.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.388 -0.968 . . . . 2.21 108.388 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -69.13 -38.18 78.7 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.815 -1.084 . . . . 2.06 109.417 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-N 115.649 -0.705 . . . . 2.05 109.471 178.275 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 111.555 0.205 . . . . 2.61 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.54 -44.57 89.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.769 0.318 . . . . 1.78 111.116 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.74 -45.91 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 1.72 110.821 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -63.52 -43.91 95.79 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 2.53 110.047 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.439 ' O ' HG23 ' A' ' 91' ' ' VAL . 19.9 mm-40 -64.09 -42.35 96.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 1.91 110.841 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.95 81.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.306 -0.407 . . . . 1.14 110.146 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -59.85 -38.58 82.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.949 -0.569 . . . . 1.11 110.168 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -65.46 -37.26 86.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 2.28 110.911 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.3 t -75.96 -35.54 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.089 0.471 . . . . 1.36 110.706 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -71.42 -36.93 71.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 1.31 110.54 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.543 ' HA ' ' OE1' ' A' ' 104' ' ' GLU . 28.7 t70 -81.06 84.46 6.5 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.765 -0.457 . . . . 0.95 109.765 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -85.89 -22.8 27.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.563 -0.744 . . . . 1.65 112.142 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.32 -11.0 58.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.977 0.418 . . . . 1.36 110.97 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.65 48.04 71.32 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.887 -0.597 . . . . 1.08 113.692 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -115.13 -6.1 12.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.99 0.395 . . . . 0.95 110.536 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 79.54 14.13 81.67 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.944 -0.646 . . . . 0.71 112.722 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -139.16 149.54 44.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.703 0.287 . . . . 1.44 110.747 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.433 HG23 HD11 ' A' ' 100' ' ' ILE . 6.0 mt -94.4 103.16 14.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.956 -0.757 . . . . 1.18 108.956 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -83.56 162.47 20.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.579 -0.737 . . . . 1.48 109.442 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.51 -36.13 73.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.004 0.43 . . . . 0.86 110.399 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.92 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 1.01 110.555 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.543 ' OE1' ' HA ' ' A' ' 93' ' ' ASP . 45.0 mt-10 -67.64 -40.37 84.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 0.88 110.825 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.757 HD23 ' CZ2' ' B' ' 292' ' ' TRP . 5.0 tp -75.12 -26.03 58.89 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.11 0.481 . . . . 0.97 110.258 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -68.09 -13.86 62.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.238 -0.653 . . . . 2.51 109.238 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -106.33 15.78 25.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.083 -0.962 . . . . 1.44 109.024 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 104' ' ' GLU . 74.7 t -120.04 -54.92 3.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.445 -0.798 . . . . 1.04 109.622 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.574 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -69.0 -12.39 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.381 -0.827 . . . . 1.88 111.301 -179.497 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -37.34 68.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.159 -0.682 . . . . 2.02 109.159 178.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -79.03 -16.74 56.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.953 -1.021 . . . . 2.2 109.115 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 109' ' ' MET . 45.5 tp -67.04 -17.24 64.81 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.06 -0.973 . . . . 1.67 109.825 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 104.29 -70.52 0.26 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.667 -0.697 . . . . 1.25 112.128 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -61.78 106.33 0.67 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.989 0.423 . . . . 2.09 111.158 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -100.29 91.45 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.023 -0.535 . . . . 2.24 109.795 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.2 mt -77.33 178.84 6.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.281 -0.872 . . . . 1.64 111.105 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -77.8 172.28 13.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.349 . . . . 1.25 111.699 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -56.09 -48.57 75.88 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.093 -0.503 . . . . 1.99 111.802 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -64.49 -35.06 79.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 2.75 111.055 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.81 -39.61 79.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.884 0.373 . . . . 1.14 110.081 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.8 t -68.65 -36.89 76.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.975 -0.75 . . . . 1.34 108.975 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.462 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 4.0 t70 -63.21 -47.71 81.37 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.454 -0.943 . . . . 1.38 108.454 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.572 ' HG2' ' NH2' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -56.49 -37.3 70.2 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.388 -0.824 . . . . 1.94 109.948 178.55 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.593 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 2.5 mtp -55.43 -50.26 70.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.278 -0.874 . . . . 1.08 111.29 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -79.49 -27.01 12.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.124 -0.63 . . . . 1.33 110.946 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.572 ' NH2' ' HG2' ' A' ' 123' ' ' GLU . 80.1 mtm-85 -63.84 -31.35 72.5 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 108.273 -1.01 . . . . 1.97 108.273 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -72.78 -29.38 63.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 114.861 -1.063 . . . . 1.55 109.459 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.42 -0.24 54.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.415 -0.812 . . . . 0.82 111.528 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -106.9 116.41 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.265 0.555 . . . . 0.8 110.5 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.4 mt -109.51 -32.15 2.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.779 -0.646 . . . . 1.45 110.725 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -77.79 -14.93 59.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.883 0.373 . . . . 1.35 110.826 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.2 30.87 64.48 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.039 -0.601 . . . . 1.25 112.259 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.429 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -89.67 -10.83 44.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.014 0.435 . . . . 1.13 110.378 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 -12.57 68.72 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.141 -0.552 . . . . 0.99 112.753 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.429 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 6.1 mt-30 -120.67 173.08 7.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 1.27 110.929 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.628 HG22 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -115.86 105.92 19.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.673 -0.694 . . . . 1.81 109.752 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.531 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 2.2 p30 -90.3 173.09 8.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.363 -0.381 . . . . 0.96 110.039 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -52.37 -44.89 65.51 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.308 0.38 . . . . 1.51 111.623 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -57.2 -55.11 38.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 1.84 111.199 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.531 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 33.8 mt-10 -64.72 -42.75 95.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.327 -0.397 . . . . 0.74 110.565 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.423 ' CD1' HD12 ' A' ' 100' ' ' ILE . 88.8 t80 -53.51 -58.0 8.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.647 -0.706 . . . . 1.04 111.436 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 65.1 t -65.81 -51.95 55.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.069 -0.514 . . . . 1.36 111.953 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -56.65 -42.82 79.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.724 0.638 . . . . 2.28 112.724 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.462 ' HE3' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -61.28 -41.3 96.71 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.945 0.35 . . . . 1.21 111.945 -179.008 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.486 ' HE3' ' HB3' ' B' ' 292' ' ' TRP . 10.1 mtt -81.25 -31.02 33.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.412 -0.358 . . . . 1.48 111.351 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.2 m -87.98 59.9 5.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.429 0.633 . . . . 1.73 110.596 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 137.14 36.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.448 -0.796 . . . . 1.64 110.237 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.094 -0.955 . . . . 3.71 109.974 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 109.92 -0.4 . . . . 2.52 109.92 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -116.9 -15.01 10.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.15 -0.477 . . . . 1.96 110.8 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -59.46 -18.84 43.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.399 -0.819 . . . . 1.33 112.594 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.401 ' ND2' HD13 ' B' ' 291' ' ' LEU . 13.7 p-10 -91.11 -32.03 16.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 120.822 0.344 . . . . 1.17 111.527 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 294' ' ' SER . 8.8 mp -70.09 -42.58 72.54 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 118.937 -0.554 . . . . 2.08 111.441 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.757 ' CZ2' HD23 ' A' ' 105' ' ' LEU . 65.5 m95 -53.48 -54.63 43.47 Favored Pre-proline 0 CA--C 1.555 1.165 0 CA-C-N 118.915 0.779 . . . . 0.51 110.387 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 43.6 Cg_exo -60.75 -20.11 64.32 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.822 1.681 . . . . 0.76 112.229 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.552 ' O ' HG12 ' B' ' 298' ' ' ILE . 73.9 m -58.5 -64.2 3.13 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.987 -1.006 . . . . 0.79 110.116 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.531 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 75.9 Cg_exo -54.57 -31.77 71.44 Favored 'Trans proline' 0 C--N 1.372 1.801 0 CA-C-N 121.978 1.742 . . . . 0.85 111.374 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . 0.475 HD23 ' SD ' ' A' ' 145' ' ' MET . 6.0 tp -61.62 -48.11 82.36 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.592 0.711 . . . . 1.42 109.5 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 32.9 ttm -67.73 -30.21 69.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.625 -0.716 . . . . 1.82 109.232 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.552 HG12 ' O ' ' B' ' 294' ' ' SER . 40.2 mm -68.36 -28.72 41.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 108.886 -0.783 . . . . 0.84 108.886 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -39.95 92.0 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.992 -1.114 . . . . 1.89 107.992 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -66.2 -40.22 90.24 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.454 -0.794 . . . . 2.86 109.093 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 7.2 m -68.39 -36.22 78.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.407 -0.815 . . . . 1.02 109.551 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -69.47 -34.7 74.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.497 -0.774 . . . . 2.62 109.36 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -33.49 75.44 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.572 -0.899 . . . . 2.21 108.572 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -72.38 -46.56 54.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.301 -0.863 . . . . 2.06 109.498 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 N--CA 1.456 -0.145 0 CA-C-N 116.071 -0.513 . . . . 2.05 109.914 179.056 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--O 1.231 0.082 0 N-CA-C 111.619 0.229 . . . . 2.61 111.619 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.28 -43.07 92.56 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.771 0.286 . . . . 1.78 111.771 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 mt -66.2 -43.63 91.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.832 0.348 . . . . 1.72 110.796 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 86' ' ' ARG . 38.5 ttt-85 -62.62 -42.26 99.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.003 -0.544 . . . . 2.53 110.642 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' O ' HG23 ' A' ' 91' ' ' VAL . 70.9 tt0 -75.23 -33.09 61.3 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 1.91 111.167 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.61 -45.35 81.51 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.824 0.345 . . . . 1.14 110.427 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -60.56 -39.13 86.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.883 -0.599 . . . . 1.11 110.436 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.428 ' NH2' ' HA2' ' A' ' 96' ' ' GLY . 6.8 tpm_? -67.63 -31.32 71.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 2.28 110.771 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.1 t -78.53 -42.96 26.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 1.36 111.239 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.08 -40.76 82.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 1.31 110.91 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.78 76.93 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.044 -0.724 . . . . 0.95 109.044 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -71.07 -28.54 64.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.225 -0.898 . . . . 1.65 111.441 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.456 ' OD1' ' HB3' ' A' ' 97' ' ' ASN . 0.0 OUTLIER -70.11 -24.17 63.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.78 -0.368 . . . . 1.36 110.473 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.428 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 71.3 58.42 5.54 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.063 -0.589 . . . . 1.08 113.856 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.456 ' HB3' ' OD1' ' A' ' 95' ' ' ASP . 14.9 p-10 -128.72 -8.12 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.234 0.54 . . . . 0.95 110.677 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.46 65.65 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.553 -0.832 . . . . 0.71 112.151 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.572 ' CE1' ' HB3' ' A' ' 137' ' ' ASN . 40.2 m-85 -140.38 124.87 17.89 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.586 0.232 . . . . 1.44 110.611 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.576 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 8.0 mt -79.03 102.79 5.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.917 -0.772 . . . . 1.18 108.917 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.3 m -77.55 161.95 27.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.51 -0.768 . . . . 1.48 110.408 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.95 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.422 . . . . 0.86 110.522 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.81 71.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 1.01 111.132 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -75.99 -41.56 50.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 0.88 110.388 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.712 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 5.5 tp -74.63 -31.64 62.05 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.199 -0.455 . . . . 0.97 111.191 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.456 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 50.3 mtm-85 -57.16 -35.62 69.77 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.224 0.535 . . . . 2.51 110.041 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -69.53 -36.92 76.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.766 -0.652 . . . . 1.44 109.319 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.0 t -66.31 -41.15 88.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.427 -0.806 . . . . 1.04 109.792 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -27.12 69.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.062 0.458 . . . . 1.88 110.604 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 21.7 m -71.49 -35.11 70.68 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.317 0.579 . . . . 2.02 109.565 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -88.09 -3.04 58.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.659 -0.701 . . . . 2.2 109.856 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.8 tp -85.79 -0.49 55.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.296 -0.866 . . . . 1.67 110.13 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.31 -62.81 4.43 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.714 -0.675 . . . . 1.25 111.724 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -74.64 96.13 2.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.987 0.423 . . . . 2.09 110.615 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -81.02 99.35 8.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 2.24 109.917 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.7 mt -90.53 167.1 12.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.606 -0.725 . . . . 1.64 110.668 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 121' ' ' VAL . 41.4 p -73.06 166.19 23.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.347 -0.388 . . . . 1.25 110.909 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.456 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 27.9 t0 -57.91 -43.06 85.94 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.511 0.189 . . . . 1.99 111.511 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -62.45 -35.32 78.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.667 0.27 . . . . 2.75 110.546 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -69.36 -38.64 78.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.779 -0.452 . . . . 1.14 109.779 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 117' ' ' THR . 55.5 t -68.26 -36.88 76.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.907 -0.775 . . . . 1.34 108.907 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -64.02 -42.65 97.06 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.897 -0.779 . . . . 1.38 108.897 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.53 -34.51 77.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.252 -0.885 . . . . 1.94 109.186 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.519 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -61.21 -50.1 74.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 1.08 110.683 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.402 ' HA ' ' HZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -75.43 -24.38 17.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.771 -0.372 . . . . 1.33 110.388 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -66.78 -29.46 69.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.657 -0.868 . . . . 1.97 108.657 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -82.76 -20.7 35.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.826 -1.079 . . . . 1.55 109.558 178.513 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -99.91 -2.36 34.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.666 -0.697 . . . . 0.82 111.363 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -106.47 112.15 25.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.147 -0.479 . . . . 0.8 109.794 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mt -107.68 -22.47 4.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.131 -0.486 . . . . 1.45 111.229 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -85.39 -13.43 49.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.808 0.337 . . . . 1.35 111.677 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.01 45.08 12.22 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.94 -0.648 . . . . 1.25 113.559 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.45 -13.52 13.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.008 0.433 . . . . 1.13 110.301 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.47 -36.92 3.96 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.801 -0.714 . . . . 0.99 112.745 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -107.67 172.3 6.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.066 0.46 . . . . 1.27 110.894 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.647 HG11 ' CH2' ' B' ' 292' ' ' TRP . 17.0 m -107.73 118.59 55.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.206 -0.664 . . . . 1.81 109.206 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.572 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.1 p30 -92.83 177.2 6.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.669 -0.493 . . . . 0.96 109.669 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -50.19 -49.1 53.58 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 123.192 0.308 . . . . 1.51 111.783 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.91 -54.98 41.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 1.84 111.257 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.0 -42.73 98.98 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.391 -0.368 . . . . 0.74 111.007 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -53.54 -55.28 26.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.69 -0.686 . . . . 1.04 111.121 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 56.2 t -69.98 -41.1 79.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.979 -0.555 . . . . 1.36 111.892 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.76 -43.99 87.2 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.517 0.562 . . . . 2.28 112.517 -178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.419 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.4 tmt? -67.28 -45.24 77.2 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.862 0.319 . . . . 1.21 111.862 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.423 ' SD ' HD23 ' B' ' 296' ' ' LEU . 29.5 mtt -72.85 -50.89 21.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.235 -0.438 . . . . 1.48 111.844 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -90.01 50.47 1.88 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.46 0.648 . . . . 1.73 111.158 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.02 66.06 4.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.75 -0.659 . . . . 1.64 110.301 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.251 -0.881 . . . . 3.71 109.747 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.022 -0.362 . . . . 2.52 110.022 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.519 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -46.33 -40.51 11.92 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.604 0.565 . . . . 1.96 112.215 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -47.6 -45.4 27.46 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.837 0.711 . . . . 1.33 112.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -91.56 -22.71 20.2 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 112.307 0.484 . . . . 1.17 112.307 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.458 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 0.1 OUTLIER -68.76 -55.5 11.08 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 118.668 -0.682 . . . . 2.08 112.067 -178.539 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.712 ' CZ3' HD12 ' A' ' 105' ' ' LEU . 84.0 m95 -49.1 -52.48 47.39 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 118.867 0.758 . . . . 0.51 110.869 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 57.6 Cg_exo -56.69 -28.47 75.66 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 122.035 1.823 . . . . 0.76 112.901 178.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.498 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 38.1 m -56.35 -62.72 4.35 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-O 118.358 -0.83 . . . . 0.79 110.915 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.564 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 64.8 Cg_exo -55.14 -31.63 76.39 Favored 'Trans proline' 0 C--N 1.369 1.645 0 CA-C-N 121.297 1.499 . . . . 0.85 111.677 176.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . 0.423 HD23 ' SD ' ' A' ' 145' ' ' MET . 10.4 tp -64.82 -42.88 94.62 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.546 0.689 . . . . 1.42 109.487 178.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 46.0 ttm -66.25 -31.04 71.61 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.399 -0.963 . . . . 1.82 108.399 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 294' ' ' SER . 38.6 mm -64.85 -30.51 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 115.135 -0.939 . . . . 0.84 109.537 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -39.05 87.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.235 -1.024 . . . . 1.89 108.235 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -61.38 -43.53 98.71 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.336 -0.987 . . . . 2.86 108.336 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.6 m -67.12 -34.69 78.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.594 -0.73 . . . . 1.02 110.133 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -68.78 -32.27 71.88 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.467 -0.568 . . . . 2.62 109.467 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -63.92 -36.46 84.03 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.747 -1.205 . . . . 2.21 107.747 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -66.63 -39.64 88.38 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.628 -1.169 . . . . 2.06 108.77 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-N 115.731 -0.668 . . . . 2.05 109.946 178.584 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 . . . . . 0 CA--C 1.52 -0.189 0 N-CA-C 111.639 0.237 . . . . 2.61 111.639 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.439 ' CD ' ' HZ1' ' B' ' 303' ' ' LYS . 0.8 OUTLIER -57.21 -43.73 83.04 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.024 0.44 . . . . 1.78 109.961 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.39 -46.2 81.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.496 -0.775 . . . . 1.72 110.983 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -63.25 -44.64 94.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.739 0.304 . . . . 2.53 110.773 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.445 ' O ' HG23 ' A' ' 91' ' ' VAL . 30.7 tt0 -65.03 -40.6 95.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.092 -0.504 . . . . 1.91 110.149 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.74 -46.68 81.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.631 -0.507 . . . . 1.14 109.631 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.08 -42.7 86.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.628 -0.715 . . . . 1.11 110.33 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -65.34 -42.97 92.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.838 -0.619 . . . . 2.28 111.162 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.511 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 89.8 t -68.33 -34.51 66.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.177 -0.465 . . . . 1.36 110.866 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.71 -38.16 64.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.33 -0.396 . . . . 1.31 110.126 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.437 ' HA ' ' OE2' ' A' ' 104' ' ' GLU . 32.0 t70 -82.48 81.59 8.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.362 0.601 . . . . 0.95 109.88 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.511 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 8.6 mttt -81.73 -15.9 52.89 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.507 -0.769 . . . . 1.65 111.766 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.43 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -81.77 -26.74 34.19 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.603 -0.439 . . . . 1.36 110.473 -179.425 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.46 23.39 40.13 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.805 -0.712 . . . . 1.08 114.848 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 12.7 p-10 -96.92 -8.51 30.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.781 0.791 . . . . 0.95 111.127 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.05 20.8 66.8 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.772 -0.728 . . . . 0.71 112.334 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -144.62 130.67 19.43 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.888 -0.412 . . . . 1.44 109.888 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.589 ' O ' HG23 ' A' ' 136' ' ' VAL . 65.7 mt -76.44 102.21 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.163 -0.68 . . . . 1.18 109.163 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -81.27 165.72 21.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.12 -0.491 . . . . 1.48 109.692 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.59 68.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.802 0.334 . . . . 0.86 111.283 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.77 -42.41 70.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.072 0.463 . . . . 1.01 110.199 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.457 ' O ' HG23 ' A' ' 108' ' ' VAL . 41.4 mt-10 -70.16 -37.06 75.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.556 -0.747 . . . . 0.88 110.304 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.809 HD11 ' CH2' ' B' ' 292' ' ' TRP . 19.2 tp -67.88 -29.39 68.48 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.329 0.585 . . . . 0.97 109.782 178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -76.91 5.11 8.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.461 -0.79 . . . . 2.51 109.926 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -125.31 16.2 8.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.303 -0.862 . . . . 1.44 109.066 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 104' ' ' GLU . 94.0 t -120.59 -66.87 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.633 -0.712 . . . . 1.04 110.535 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.651 ' SD ' HD13 ' A' ' 105' ' ' LEU . 0.8 OUTLIER -67.77 -18.88 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.672 -0.695 . . . . 1.88 111.323 -178.788 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -45.88 51.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.653 0.74 . . . . 2.02 109.383 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.87 -25.29 65.45 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 114.972 -1.013 . . . . 2.2 109.389 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 109' ' ' MET . 11.6 tp -60.28 -25.59 65.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.865 -1.061 . . . . 1.67 110.554 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.98 -35.18 4.28 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.921 -0.657 . . . . 1.25 111.903 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -66.91 102.64 0.99 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.0 0.429 . . . . 2.09 111.001 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -85.2 85.51 7.46 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.897 -0.592 . . . . 2.24 109.901 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.0 mt -95.57 162.61 13.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.577 -0.738 . . . . 1.64 111.45 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 22.3 p -87.14 170.56 11.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.352 -0.84 . . . . 1.25 110.524 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -55.94 -42.7 76.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 1.99 110.921 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.55 -39.89 92.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.288 -0.415 . . . . 2.75 110.753 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.87 -37.23 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 1.14 110.248 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 124' ' ' MET . 56.1 t -67.19 -36.24 76.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.8 -0.815 . . . . 1.34 108.8 177.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 23.5 t70 -63.59 -43.12 97.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.34 -0.846 . . . . 1.38 109.395 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.11 -34.69 78.16 Favored 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 109.406 -0.59 . . . . 1.94 109.406 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.676 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 5.6 mtp -60.07 -50.77 72.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.565 -0.743 . . . . 1.08 110.499 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.584 ' CD1' HG21 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -75.45 -22.81 16.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.664 -0.414 . . . . 1.33 110.197 179.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 10.2 ttm180 -67.05 -23.6 65.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.289 -0.634 . . . . 1.97 109.289 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -92.55 -19.39 22.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.036 -0.984 . . . . 1.55 110.729 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.44 -41.22 8.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.893 0.331 . . . . 0.82 111.893 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 106.99 12.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.22 0.534 . . . . 0.8 110.002 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -99.64 -34.09 4.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.565 -0.743 . . . . 1.45 110.972 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -74.55 -23.59 58.81 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.631 0.253 . . . . 1.35 111.242 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.04 29.4 34.31 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.77 -0.729 . . . . 1.25 112.743 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -84.92 -20.3 30.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.901 0.381 . . . . 1.13 110.32 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.03 -7.9 59.04 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 121.031 -0.604 . . . . 0.99 112.943 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -128.26 163.71 24.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.392 0.615 . . . . 1.27 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.672 HG11 ' CZ3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -99.73 101.15 11.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.188 -0.915 . . . . 1.81 108.826 178.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -86.34 171.61 11.06 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.768 -0.373 . . . . 0.96 110.579 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -51.71 -50.41 60.57 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.498 0.499 . . . . 1.51 111.957 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.67 -55.03 39.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.604 -0.271 . . . . 1.84 111.463 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.55 -43.45 97.21 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.816 0.341 . . . . 0.74 110.547 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -55.03 -54.26 45.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.603 -0.726 . . . . 1.04 111.178 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 89.9 t -70.16 -43.89 78.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 1.36 112.045 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -63.35 -44.0 96.09 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.333 0.494 . . . . 2.28 112.333 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.511 ' HE2' ' CD1' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -68.78 -44.75 72.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.804 0.298 . . . . 1.21 111.804 -178.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 34.9 mtt -71.95 -47.7 50.46 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.993 0.368 . . . . 1.48 111.993 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 47.62 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.379 0.609 . . . . 1.73 110.527 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.59 130.27 41.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.424 -0.807 . . . . 1.64 110.268 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.188 -0.911 . . . . 3.71 109.843 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.854 0.359 . . . . 2.52 110.42 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.676 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -134.84 -10.29 2.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 1.96 111.168 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -56.39 -21.94 28.18 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 115.754 -0.657 . . . . 1.33 112.092 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.432 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 12.5 p-10 -92.0 -29.45 16.6 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.038 0.447 . . . . 1.17 111.315 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.577 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -72.21 -41.24 67.14 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-O 118.552 -0.737 . . . . 2.08 112.946 -177.685 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.809 ' CH2' HD11 ' A' ' 105' ' ' LEU . 66.0 m95 -57.73 -50.7 86.67 Favored Pre-proline 0 C--O 1.246 0.882 0 CA-C-N 119.546 1.066 . . . . 0.51 109.179 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.56 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 52.3 Cg_exo -58.34 -21.24 51.99 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.481 1.454 . . . . 0.76 111.735 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.577 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 69.4 m -57.63 -63.47 3.75 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-O 118.08 -0.962 . . . . 0.79 110.102 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.61 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 74.3 Cg_exo -55.72 -29.95 73.59 Favored 'Trans proline' 0 C--N 1.376 2.009 0 CA-C-N 121.815 1.684 . . . . 0.85 111.361 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 tp -65.25 -44.18 88.97 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.328 0.585 . . . . 1.42 109.763 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 69.2 mtm -68.17 -31.23 70.63 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.235 -1.024 . . . . 1.82 108.235 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.48 HG12 ' O ' ' B' ' 294' ' ' SER . 38.1 mm -66.84 -28.94 44.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 N-CA-C 108.752 -0.833 . . . . 0.84 108.752 177.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -42.41 93.06 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.565 -0.902 . . . . 1.89 108.565 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -70.53 -35.76 73.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.632 -0.713 . . . . 2.86 109.507 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 13.6 m -67.52 -44.9 77.27 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.407 -0.59 . . . . 1.02 109.407 178.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' B' ' 298' ' ' ILE . 0.1 OUTLIER -64.22 -36.24 83.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.592 -0.731 . . . . 2.62 109.237 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . 0.439 ' HZ1' ' CD ' ' A' ' 84' ' ' GLU . 23.6 tttp -58.12 -44.31 87.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.644 -0.707 . . . . 2.21 109.462 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -68.59 -44.92 73.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.808 . . . . 2.06 109.982 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 2.05 110.538 179.358 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.407 ' H ' ' CD ' ' A' ' 83' ' ' GLU . 1.5 mp0 . . . . . 0 N--CA 1.464 0.232 0 CA-C-O 120.819 0.343 . . . . 2.61 110.846 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.2 -34.66 73.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 1.78 110.502 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.4 -46.73 89.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.989 -0.55 . . . . 1.72 110.829 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -59.09 -44.22 91.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.108 -0.496 . . . . 2.53 110.576 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.485 ' CD ' ' HZ1' ' B' ' 299' ' ' LYS . 1.0 OUTLIER -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.813 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.73 80.75 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.136 0.493 . . . . 1.14 109.982 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -62.02 -38.72 89.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.241 -0.89 . . . . 1.11 110.163 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -71.86 -27.8 63.12 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.79 -0.641 . . . . 2.28 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.8 t -83.13 -45.04 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.378 -0.373 . . . . 1.36 111.258 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -66.69 -32.64 74.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.3 -0.409 . . . . 1.31 110.994 -179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -83.73 91.42 7.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.91 -0.774 . . . . 0.95 108.91 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -85.27 -33.28 22.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.831 -0.622 . . . . 1.65 112.116 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.476 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -69.14 -29.27 67.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.678 -0.409 . . . . 1.36 110.293 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.86 28.28 26.62 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.011 -0.614 . . . . 1.08 114.267 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.476 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 20.0 p-10 -90.8 -8.22 50.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 117.729 0.764 . . . . 0.95 110.781 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.0 17.5 61.15 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.831 -0.699 . . . . 0.71 111.728 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.432 ' HB2' HD22 ' A' ' 97' ' ' ASN . 98.6 m-85 -144.54 145.32 31.77 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.76 0.314 . . . . 1.44 110.346 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.596 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 38.1 mt -90.85 100.81 11.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.954 -0.566 . . . . 1.18 109.65 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -79.35 163.19 25.06 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 1.48 110.442 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.02 -43.01 81.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 0.86 110.093 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.08 91.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.871 -0.604 . . . . 1.01 110.839 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 108' ' ' VAL . 45.5 mt-10 -69.46 -37.83 77.49 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.537 -0.756 . . . . 0.88 111.036 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.7 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 10.1 tp -72.92 -29.79 63.4 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.766 0.317 . . . . 0.97 110.4 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 31.0 mtm-85 -61.31 -32.68 72.54 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.013 0.435 . . . . 2.51 110.306 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -82.26 -6.45 59.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.495 0.664 . . . . 1.44 110.686 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 104' ' ' GLU . 85.6 t -92.54 -51.82 10.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.902 -0.59 . . . . 1.04 110.288 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.548 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -69.22 -16.91 63.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.756 -0.656 . . . . 1.88 112.151 -178.69 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.41 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 0.4 OUTLIER -72.1 -35.84 69.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.934 0.397 . . . . 2.02 109.969 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -76.54 -20.47 56.84 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.675 -0.693 . . . . 2.2 109.864 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.3 tp -71.96 -10.75 60.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.219 -0.901 . . . . 1.67 110.508 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 92.62 -42.72 2.66 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.797 -0.716 . . . . 1.25 111.342 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.02 75.69 5.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 2.09 110.148 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 57.3 mttp -73.66 113.02 10.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.441 -0.8 . . . . 2.24 110.545 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.97 179.85 4.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.912 -0.586 . . . . 1.64 110.06 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.3 p -87.32 171.09 10.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.475 -0.33 . . . . 1.25 110.845 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.464 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 25.1 t0 -59.19 -42.39 90.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.327 -0.397 . . . . 1.99 111.443 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -42.4 99.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.751 0.31 . . . . 2.75 110.534 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -65.02 -37.79 88.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 1.14 110.326 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.9 t -69.47 -40.86 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.724 -0.473 . . . . 1.34 109.724 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.47 -40.03 94.93 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.502 -0.555 . . . . 1.38 109.502 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -64.78 -34.0 77.31 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 109.161 -0.681 . . . . 1.94 109.161 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.494 ' CE ' ' HE2' ' A' ' 109' ' ' MET . 8.0 mtp -60.87 -45.92 92.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 1.08 110.006 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.454 ' HA ' ' HB2' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -77.79 -19.78 13.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.593 -0.443 . . . . 1.33 109.832 179.14 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -68.99 -30.25 68.62 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.11 -1.07 . . . . 1.97 108.11 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -88.36 -11.19 46.96 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.422 -1.263 . . . . 1.55 109.206 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB2' ' HA ' ' A' ' 125' ' ' ILE . . . -109.23 1.27 20.12 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.594 -0.73 . . . . 0.82 112.11 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -115.17 129.06 56.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.633 -0.506 . . . . 0.8 109.633 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.93 -33.59 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.255 -0.43 . . . . 1.45 111.132 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 1.4 p-10 -69.96 -25.3 63.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.874 0.369 . . . . 1.35 111.11 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.49 64.84 1.32 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.467 -0.873 . . . . 1.25 111.795 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.459 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.7 OUTLIER -131.45 -18.27 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.679 0.276 . . . . 1.13 110.793 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.47 -25.86 26.74 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.577 -0.82 . . . . 0.99 113.065 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -116.44 176.1 5.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 1.27 110.216 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.684 HG11 ' CH2' ' B' ' 292' ' ' TRP . 30.0 m -106.82 122.01 60.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 1.81 108.692 178.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.404 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 28.7 p30 -94.57 -177.99 4.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.426 -0.352 . . . . 0.96 110.17 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -55.92 -49.25 73.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.793 0.33 . . . . 1.51 111.694 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.73 -54.09 49.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.106 -0.497 . . . . 1.84 111.632 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.404 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 41.2 mt-10 -61.76 -39.69 92.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.341 -0.39 . . . . 0.74 111.758 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -56.39 -58.62 7.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 1.04 111.376 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 22.6 t -65.87 -37.06 79.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.224 -0.443 . . . . 1.36 111.366 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -62.54 -44.18 96.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 2.28 111.582 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -45.14 65.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.883 0.373 . . . . 1.21 110.796 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.409 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -62.42 -39.3 92.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.098 -0.501 . . . . 1.48 111.659 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.57 37.52 2.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.104 0.478 . . . . 1.73 110.776 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.92 81.7 8.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.151 -0.477 . . . . 1.64 111.006 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.389 -0.815 . . . . 3.71 109.538 179.489 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.821 0.343 . . . . 2.52 110.591 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.96 -41.77 97.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.566 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -45.77 -41.83 11.32 Favored 'General case' 0 C--O 1.223 -0.335 0 O-C-N 123.966 0.791 . . . . 1.33 113.032 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -90.73 -27.93 18.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.876 -0.33 . . . . 1.17 111.885 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.554 ' O ' ' HB2' ' B' ' 294' ' ' SER . 2.5 tp -73.53 -44.85 56.65 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 113.004 0.742 . . . . 2.08 113.004 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.7 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 69.1 m95 -54.26 -53.66 56.58 Favored Pre-proline 0 CA--C 1.551 1.004 0 CA-C-N 119.534 1.061 . . . . 0.51 109.526 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 42.9 Cg_exo -61.35 -20.82 69.87 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 121.637 1.558 . . . . 0.76 112.428 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.573 ' O ' HG12 ' B' ' 298' ' ' ILE . 43.4 m -55.97 -64.79 1.95 Allowed Pre-proline 0 CA--C 1.544 0.73 0 CA-C-O 118.381 -0.819 . . . . 0.79 110.375 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.565 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 46.0 Cg_exo -59.24 -31.23 94.83 Favored 'Trans proline' 0 C--N 1.37 1.689 0 CA-C-N 121.494 1.569 . . . . 0.85 111.234 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.5 -46.39 90.29 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.186 0.517 . . . . 1.42 109.871 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 41.6 ttm -68.33 -31.82 71.49 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.361 -0.607 . . . . 1.82 109.361 178.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.573 HG12 ' O ' ' B' ' 294' ' ' SER . 43.4 mm -62.01 -34.97 65.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.856 -0.794 . . . . 0.84 108.856 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . 0.485 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 2.6 tttp -66.39 -40.92 89.95 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.765 -0.652 . . . . 1.89 109.85 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -61.34 -42.62 98.98 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.886 -0.783 . . . . 2.86 108.886 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 301' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' B' ' 304' ' ' ASN . 6.4 m -70.55 -30.13 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.563 -0.744 . . . . 1.02 109.858 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 5.6 tptp -67.68 -33.75 75.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.172 -0.677 . . . . 2.62 109.172 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -65.81 -37.59 86.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.205 -1.035 . . . . 2.21 108.205 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' B' ' 301' ' ' SER . 22.6 t30 -63.86 -41.15 97.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.76 -1.109 . . . . 2.06 108.792 177.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.581 -0.736 . . . . 2.05 109.602 178.202 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.43 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 112.019 0.377 . . . . 2.61 112.019 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.425 ' CD ' ' HZ2' ' B' ' 303' ' ' LYS . 1.6 mp0 -53.47 -44.58 69.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.183 0.438 . . . . 1.78 112.183 -178.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.457 ' HA ' HD12 ' B' ' 296' ' ' LEU . 2.4 mt -65.25 -41.43 91.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.993 0.425 . . . . 1.72 111.188 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -68.79 -43.79 74.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.055 -0.52 . . . . 2.53 110.827 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 mm-40 -70.79 -35.04 72.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.86 -0.609 . . . . 1.91 112.063 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.26 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.747 0.308 . . . . 1.14 110.756 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -59.19 -42.06 89.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.554 . . . . 1.11 110.377 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.06 -29.79 66.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.903 -0.59 . . . . 2.28 110.536 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.46 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 57.9 t -74.71 -41.09 47.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 1.36 110.438 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -71.89 -37.25 70.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.069 -0.514 . . . . 1.31 110.791 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -83.68 104.89 14.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.658 -0.497 . . . . 0.95 109.658 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.46 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 5.2 mptt -91.43 -39.29 12.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.089 -0.505 . . . . 1.65 111.224 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -69.48 -20.61 63.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.17 -0.468 . . . . 1.36 110.807 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.79 68.81 1.54 Allowed Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.153 -0.546 . . . . 1.08 112.774 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.497 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 24.2 p-10 -137.05 -0.41 2.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.891 0.377 . . . . 0.95 110.513 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.97 22.0 72.65 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.656 -0.783 . . . . 0.71 111.73 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.497 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 57.6 m-85 -142.82 122.86 13.63 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.688 0.28 . . . . 1.44 110.773 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.716 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 60.2 mt -82.13 102.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.712 -0.847 . . . . 1.18 108.712 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.6 t -76.32 163.29 27.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.592 -0.522 . . . . 1.48 109.592 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.5 -39.05 75.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.996 0.427 . . . . 0.86 110.459 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.91 88.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 1.01 110.508 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.71 -32.52 72.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.819 -0.628 . . . . 0.88 110.692 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.8 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 10.4 tp -77.27 -34.93 55.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.263 -0.426 . . . . 0.97 110.11 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 19.0 mtm180 -60.01 -34.22 73.05 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.515 -0.55 . . . . 2.51 109.515 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.09 -28.12 68.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.44 -0.8 . . . . 1.44 109.674 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.5 -35.33 44.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 1.04 109.998 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -34.77 73.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.214 -0.448 . . . . 1.88 110.345 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 m -63.8 -36.73 84.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.903 -0.589 . . . . 2.02 110.886 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -84.74 -27.34 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.145 0.498 . . . . 2.2 109.952 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.84 -27.98 67.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.69 -0.686 . . . . 1.67 109.979 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.03 -49.77 0.86 Allowed Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.801 -0.636 . . . . 1.25 111.685 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.48 100.16 8.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.068 0.461 . . . . 2.09 110.019 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -82.88 82.49 8.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.737 -0.665 . . . . 2.24 109.816 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.1 mt -72.54 166.66 22.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.689 -0.687 . . . . 1.64 111.691 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.4 p -77.4 168.67 19.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 1.25 111.095 -179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.18 -37.14 74.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.12 -0.491 . . . . 1.99 111.199 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -68.36 -37.36 80.38 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.894 0.378 . . . . 2.75 110.412 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -71.68 -34.28 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.784 -0.45 . . . . 1.14 109.784 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 124' ' ' MET . 77.0 t -67.78 -36.8 77.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.409 -0.96 . . . . 1.34 108.409 177.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 12.6 t70 -63.51 -41.99 98.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.131 -0.94 . . . . 1.38 108.572 177.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -60.65 -37.01 80.1 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.811 -0.631 . . . . 1.94 109.468 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.621 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 9.3 mtp -56.72 -51.46 68.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.218 -0.901 . . . . 1.08 111.777 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.56 ' CG2' HG21 ' A' ' 136' ' ' VAL . 1.4 mt -85.45 -14.07 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 119.077 -1.049 . . . . 1.33 111.382 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 20.0 ttm180 -68.11 -25.26 65.22 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.824 -1.176 . . . . 1.97 107.824 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -97.5 -5.44 35.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 113.898 -1.501 . . . . 1.55 109.605 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.85 -44.59 5.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.16 -0.473 . . . . 0.82 111.733 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -76.59 132.38 39.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.083 0.468 . . . . 0.8 111.179 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 37.4 mt -130.29 -23.59 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.799 -0.637 . . . . 1.45 110.893 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.47 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 1.1 p-10 -77.03 -22.4 53.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.426 -0.352 . . . . 1.35 111.828 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 98.62 -0.21 58.01 Favored Glycine 0 C--O 1.236 0.28 0 C-N-CA 120.434 -0.889 . . . . 1.25 113.699 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.47 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.1 OUTLIER -70.49 -24.68 62.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.277 0.538 . . . . 1.13 110.078 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.73 -8.17 59.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.852 -0.689 . . . . 0.99 113.461 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -123.89 -179.63 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.557 0.694 . . . . 1.27 111.169 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.716 ' CG2' ' HB ' ' A' ' 100' ' ' ILE . 0.0 OUTLIER -102.89 96.61 4.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 114.644 -1.162 . . . . 1.81 109.165 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.424 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 27.7 p30 -88.71 176.01 7.27 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.48 -0.488 . . . . 0.96 109.933 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -52.85 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.627 0.603 . . . . 1.51 112.627 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 30.5 mp0 -62.59 -50.82 69.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.457 -0.338 . . . . 1.84 111.776 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.424 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 39.4 mt-10 -62.67 -41.97 99.37 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.913 0.387 . . . . 0.74 110.706 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.426 ' HE2' ' O ' ' A' ' 85' ' ' ILE . 75.4 t80 -56.03 -56.25 23.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.535 -0.757 . . . . 1.04 111.365 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.42 -38.28 81.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.083 -0.508 . . . . 1.36 111.447 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.6 -41.52 92.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 2.28 111.429 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.608 ' HE2' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.71 -38.94 62.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.039 0.447 . . . . 1.21 110.913 -179.612 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.585 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -67.46 -47.64 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.495 . . . . 1.48 110.901 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.64 48.68 1.02 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.226 0.536 . . . . 1.73 109.895 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.45 101.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.671 -0.695 . . . . 1.64 110.804 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.308 -0.853 . . . . 3.71 109.833 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . 0.419 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.723 0.297 . . . . 2.52 110.23 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.621 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -114.96 -33.9 5.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.254 -0.43 . . . . 1.96 111.178 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.33 -30.37 4.84 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 123.914 0.759 . . . . 1.33 112.344 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.476 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 20.3 p-10 -92.79 -34.18 13.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.302 0.482 . . . . 1.17 112.302 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.472 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 9.6 mp -68.79 -46.66 68.14 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-O 118.3 -0.857 . . . . 2.08 112.724 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.8 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 59.8 m95 -52.98 -50.9 79.33 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-N 119.738 1.153 . . . . 0.51 109.927 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.56 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -64.01 -17.48 59.95 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 121.631 1.554 . . . . 0.76 112.385 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.544 ' O ' HG12 ' B' ' 298' ' ' ILE . 74.2 m -60.32 -61.52 7.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-O 118.547 -0.739 . . . . 0.79 110.289 178.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -60.88 -27.47 84.85 Favored 'Trans proline' 0 C--N 1.37 1.673 0 CA-C-N 121.481 1.565 . . . . 0.85 110.19 176.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 85' ' ' ILE . 4.4 tp -59.49 -47.74 84.33 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.041 -0.725 . . . . 1.42 109.041 177.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 50.3 ttm -67.33 -32.44 73.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.753 -0.658 . . . . 1.82 109.265 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.544 HG12 ' O ' ' B' ' 294' ' ' SER . 45.2 mm -65.66 -31.46 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.63 -0.714 . . . . 0.84 109.108 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -38.0 87.68 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.977 -1.12 . . . . 1.89 107.977 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' B' ' 303' ' ' LYS . 0.4 OUTLIER -65.36 -35.94 82.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.244 -0.889 . . . . 2.86 108.733 177.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.4 m -69.83 -36.43 75.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.659 -0.867 . . . . 1.02 108.659 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.5 tptp -67.75 -31.34 71.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.902 -0.777 . . . . 2.62 108.902 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . 0.425 ' HZ2' ' CD ' ' A' ' 84' ' ' GLU . 17.9 tttp -63.52 -43.73 96.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.214 -0.903 . . . . 2.21 108.794 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -69.49 -37.36 77.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.374 -0.83 . . . . 2.06 109.137 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.711 -0.677 . . . . 2.05 109.403 178.06 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.106 0.479 . . . . 2.61 110.313 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -57.54 -47.66 81.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.417 -0.811 . . . . 1.78 110.516 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.0 mt -72.02 -32.43 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.672 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -65.3 -45.79 82.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.116 -0.493 . . . . 2.53 110.157 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.48 ' O ' HG23 ' A' ' 91' ' ' VAL . 3.3 tt0 -66.62 -38.21 86.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 1.91 109.818 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.39 82.08 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.002 -0.544 . . . . 1.14 110.41 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.81 -40.9 89.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 1.11 110.407 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -66.33 -36.62 83.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.869 -0.605 . . . . 2.28 110.737 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 87' ' ' GLU . 58.6 t -71.84 -36.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.175 -0.466 . . . . 1.36 110.472 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -66.44 -54.03 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.476 . . . . 1.31 110.052 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -83.89 96.68 8.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.95 110.014 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -90.65 -34.6 15.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.71 -0.677 . . . . 1.65 111.63 -178.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.571 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 1.1 p-10 -68.72 -25.64 64.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.839 0.352 . . . . 1.36 110.7 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.28 44.02 7.19 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.853 -0.689 . . . . 1.08 113.121 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.571 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 4.8 p-10 -97.1 -7.56 32.38 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.731 -0.47 . . . . 0.95 109.731 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.2 0.7 76.71 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.848 -0.614 . . . . 0.71 113.576 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.408 ' HB2' HD22 ' A' ' 97' ' ' ASN . 71.3 m-85 -141.09 155.33 46.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.88 0.371 . . . . 1.44 110.639 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.64 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 84.9 mt -83.67 100.48 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.89 -0.781 . . . . 1.18 108.89 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -72.51 155.45 40.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.432 -0.349 . . . . 1.48 110.426 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.57 -35.81 75.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.119 0.485 . . . . 0.86 110.229 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.18 -37.89 81.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 1.01 109.972 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.51 -30.41 61.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.664 -0.698 . . . . 0.88 110.142 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.754 HD11 ' CH2' ' B' ' 292' ' ' TRP . 18.8 tp -72.15 -40.64 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.859 -0.609 . . . . 0.97 109.954 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.492 ' HG2' ' CG1' ' A' ' 121' ' ' VAL . 20.3 mtm180 -57.61 -33.35 68.14 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.466 -0.334 . . . . 2.51 110.586 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.795 -0.639 . . . . 1.44 109.744 179.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.43 -40.82 78.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.724 -0.671 . . . . 1.04 110.403 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.611 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -61.12 -46.95 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.939 -0.573 . . . . 1.88 111.049 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.7 p -70.57 -32.58 70.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.885 0.374 . . . . 2.02 111.157 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -71.03 -28.16 64.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.285 -0.416 . . . . 2.2 110.156 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 51.7 tp -64.69 -29.56 70.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.82 -0.627 . . . . 1.67 110.465 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 111.3 -41.72 2.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.854 -0.688 . . . . 1.25 111.701 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -74.07 100.49 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.28 0.562 . . . . 2.09 109.784 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -81.87 123.13 28.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.509 -0.768 . . . . 2.24 111.268 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.0 mt -118.45 162.56 18.14 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.727 -0.67 . . . . 1.64 109.698 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 121' ' ' VAL . 26.6 p -75.07 168.22 20.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.992 -0.373 . . . . 1.25 109.992 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.3 -36.5 75.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.947 0.403 . . . . 1.99 110.249 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.01 -45.03 83.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.712 -0.677 . . . . 2.75 110.155 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.75 -38.41 86.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 1.14 110.708 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.541 ' O ' ' HB2' ' A' ' 124' ' ' MET . 85.1 t -67.12 -40.89 86.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.481 -0.563 . . . . 1.34 109.481 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 21.3 t70 -64.5 -40.07 94.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.046 -0.724 . . . . 1.38 109.046 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.04 -35.24 74.68 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.563 -0.532 . . . . 1.94 109.563 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.604 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -55.86 -45.08 78.59 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 1.08 109.763 178.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.663 ' CD1' HG21 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -81.05 -27.82 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.845 -0.616 . . . . 1.33 111.202 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 44.2 mtm-85 -68.92 -19.93 64.21 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.451 0.643 . . . . 1.97 109.663 178.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.17 -13.28 26.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.056 -0.975 . . . . 1.55 109.876 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -102.44 -35.82 8.64 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.736 -0.666 . . . . 0.82 111.572 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -83.47 104.87 13.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.936 0.398 . . . . 0.8 110.294 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.66 -32.4 3.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.854 -0.612 . . . . 1.45 111.303 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.414 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 0.6 OUTLIER -74.8 -12.93 60.51 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 1.35 111.375 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 69.53 61.02 4.68 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.102 -0.57 . . . . 1.25 112.538 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.414 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.9 OUTLIER -118.46 -19.85 8.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.552 0.215 . . . . 1.13 110.669 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.27 -22.46 32.86 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.669 -0.777 . . . . 0.99 112.941 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -122.81 173.29 7.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 1.27 111.047 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.669 HG11 ' CH2' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -101.02 109.83 26.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.531 -0.759 . . . . 1.81 109.233 179.497 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.4 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 24.4 p30 -89.69 174.13 7.91 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.399 -0.521 . . . . 0.96 110.152 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -55.36 -49.54 72.01 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.46 0.541 . . . . 1.51 112.46 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.92 -52.98 63.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.316 -0.402 . . . . 1.84 111.863 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.4 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 45.3 mt-10 -61.57 -37.14 82.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.74 110.624 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -56.55 -54.83 41.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 1.04 110.797 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.7 t -70.23 -41.36 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.798 -0.637 . . . . 1.36 111.423 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -58.34 -52.29 66.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 2.28 112.156 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.511 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -66.38 -44.2 83.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.268 -0.424 . . . . 1.21 112.028 -178.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.409 ' HE3' ' O ' ' B' ' 292' ' ' TRP . 36.4 mtt -69.1 -45.16 70.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.829 0.347 . . . . 1.48 111.702 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 63.14 2.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.026 0.441 . . . . 1.73 110.214 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -94.99 157.16 16.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.91 -0.586 . . . . 1.64 111.326 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.301 -0.857 . . . . 3.71 109.169 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.363 -0.606 . . . . 2.52 109.363 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.604 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -116.55 0.72 12.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.859 -0.61 . . . . 1.96 111.829 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -39.39 -29.88 0.06 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.645 0.98 . . . . 1.33 113.645 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.48 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 9.0 p-10 -83.66 -21.69 32.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 117.607 0.185 . . . . 1.17 111.305 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.796 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 2.1 mp -71.5 -40.02 70.43 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-O 118.999 -0.524 . . . . 2.08 111.343 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.754 ' CH2' HD11 ' A' ' 105' ' ' LEU . 64.1 m95 -56.4 -51.68 79.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 119.235 -0.986 . . . . 0.51 108.8 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.607 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 51.2 Cg_exo -60.15 -19.71 58.07 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.59 1.527 . . . . 0.76 112.354 176.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.522 ' O ' HG12 ' B' ' 298' ' ' ILE . 49.6 m -57.08 -63.66 3.41 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.802 -0.618 . . . . 0.79 110.29 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.796 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 11.2 Cg_endo -58.78 -29.61 90.29 Favored 'Trans proline' 0 C--N 1.369 1.61 0 CA-C-N 120.915 1.363 . . . . 0.85 110.94 176.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 8.3 tp -64.57 -39.01 92.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.098 -0.705 . . . . 1.42 109.098 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 38.4 ttm -70.63 -32.81 70.27 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.655 -0.869 . . . . 1.82 108.655 178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.522 HG12 ' O ' ' B' ' 294' ' ' SER . 49.0 mm -65.42 -29.88 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 108.502 -0.925 . . . . 0.84 108.502 177.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -39.36 82.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.515 -0.921 . . . . 1.89 108.515 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -64.66 -39.81 94.33 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.58 -0.896 . . . . 2.86 108.58 177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 8.8 m -69.19 -36.35 77.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.14 -0.936 . . . . 1.02 109.468 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -64.53 -37.08 86.3 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.24 -0.652 . . . . 2.62 109.24 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -62.18 -43.61 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.833 -0.621 . . . . 2.21 109.356 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -68.12 -43.32 78.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.592 -0.731 . . . . 2.06 109.454 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.626 . . . . 2.05 109.988 179.509 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.738 0.304 . . . . 2.61 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.62 -35.89 77.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 1.78 110.452 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.1 mt -71.98 -40.96 68.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.144 -0.48 . . . . 1.72 110.71 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HG3' ' OH ' ' A' ' 138' ' ' TYR . 42.9 ttt-85 -65.71 -47.74 74.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.304 -0.407 . . . . 2.53 110.449 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.404 ' O ' HG23 ' A' ' 91' ' ' VAL . 21.7 mm-40 -68.43 -26.85 65.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 1.91 110.814 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.05 -38.62 89.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.25 -0.432 . . . . 1.14 110.114 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -59.62 -39.36 84.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 1.11 109.945 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -67.34 -38.88 85.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.894 -0.594 . . . . 2.28 110.185 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 87' ' ' GLU . 61.4 t -70.9 -35.58 60.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 1.36 110.484 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -69.13 -49.96 52.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.943 -0.571 . . . . 1.31 109.958 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -81.6 74.48 8.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.95 109.741 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -66.97 -28.81 68.57 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.65 111.763 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.426 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.0 OUTLIER -74.8 -31.32 61.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.825 0.345 . . . . 1.36 110.471 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.53 60.55 2.62 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.895 -0.669 . . . . 1.08 113.23 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.426 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 7.6 p-10 -122.99 -7.02 8.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.95 110.097 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.11 10.53 68.76 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.742 -0.663 . . . . 0.71 112.965 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -142.51 129.59 20.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.883 0.373 . . . . 1.44 111.221 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.512 ' HB ' HG21 ' A' ' 136' ' ' VAL . 54.9 mt -79.68 103.04 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.941 -0.763 . . . . 1.18 108.941 178.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 43.9 t -82.0 160.62 23.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.829 -0.623 . . . . 1.48 110.255 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.491 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.01 -39.09 80.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 0.86 110.304 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.37 -35.58 81.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 1.01 110.558 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.35 -36.96 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.976 -0.556 . . . . 0.88 110.055 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.736 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 12.4 tp -66.94 -34.5 77.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.254 0.549 . . . . 0.97 109.562 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 16.1 mtm180 -70.22 -15.69 62.96 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.879 -0.6 . . . . 2.51 110.198 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.92 4.3 52.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.321 0.581 . . . . 1.44 110.13 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.2 t -114.14 -49.44 5.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.41 -0.814 . . . . 1.04 109.276 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -8.42 51.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.883 . . . . 1.88 111.826 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.445 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -72.53 -41.55 65.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.366 0.603 . . . . 2.02 109.63 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -78.12 -14.56 59.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.415 -0.812 . . . . 2.2 109.919 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.4 tt -63.54 -32.62 74.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 1.67 110.135 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.57 -62.57 0.29 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.242 -0.743 . . . . 1.25 111.242 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.53 82.31 4.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.243 0.544 . . . . 2.09 110.161 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 110' ' ' THR . 34.8 mttp -81.73 111.16 17.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.713 -0.676 . . . . 2.24 110.214 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.45 ' HB2' ' HB2' ' A' ' 120' ' ' GLU . 0.1 OUTLIER -85.33 175.25 9.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.334 -0.394 . . . . 1.64 110.816 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.469 ' O ' HG22 ' A' ' 121' ' ' VAL . 37.0 p -73.61 163.62 27.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.386 -0.37 . . . . 1.25 110.903 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -61.48 -31.41 71.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.956 0.408 . . . . 1.99 110.211 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -64.31 -40.26 95.56 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.48 0.657 . . . . 2.75 109.404 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.45 ' HB2' ' HB2' ' A' ' 116' ' ' LEU . 46.6 mt-10 -74.44 -33.19 62.87 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.328 -0.851 . . . . 1.14 110.223 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 117' ' ' THR . 81.8 t -61.43 -40.23 85.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 108.225 -1.028 . . . . 1.34 108.225 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.23 -45.0 95.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.653 -1.158 . . . . 1.38 109.531 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.61 -38.32 90.59 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.0 -0.546 . . . . 1.94 110.204 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.408 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 6.5 mtp -59.5 -48.0 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 1.08 111.136 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.442 ' HA ' ' HZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -73.97 -35.27 41.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 C-N-CA 120.539 -0.465 . . . . 1.33 110.414 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 126' ' ' ARG . 28.5 mtm180 -64.62 -34.05 77.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.051 0.453 . . . . 1.97 110.018 178.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -73.45 -17.78 61.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.485 0.66 . . . . 1.55 109.417 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -108.17 8.69 28.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.378 -0.828 . . . . 0.82 110.21 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -117.17 116.03 26.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.049 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.53 -29.45 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.155 -0.475 . . . . 1.45 110.734 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.529 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 0.6 OUTLIER -77.22 -15.24 59.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 1.35 110.64 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.45 60.66 4.58 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.239 -0.505 . . . . 1.25 112.819 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.529 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.6 OUTLIER -123.66 -17.08 6.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.586 0.231 . . . . 1.13 111.468 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.05 -3.79 55.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.371 -0.918 . . . . 0.99 113.065 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -136.41 161.45 35.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.696 -0.483 . . . . 1.27 109.696 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.578 HG11 ' CH2' ' B' ' 292' ' ' TRP . 3.2 m -106.81 115.46 48.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 108.865 -0.791 . . . . 1.81 108.865 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.589 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.2 p30 -88.54 -176.22 5.22 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.851 -0.425 . . . . 0.96 109.851 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.408 ' OH ' ' HG3' ' A' ' 86' ' ' ARG . 18.7 t80 -59.34 -45.88 90.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.755 0.312 . . . . 1.51 111.746 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.28 -42.03 99.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.279 -0.419 . . . . 1.84 111.249 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.589 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 26.4 mt-10 -73.34 -32.17 64.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.74 110.132 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.83 -56.94 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.244 -0.889 . . . . 1.04 110.851 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.55 -33.01 55.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 115.851 -0.613 . . . . 1.36 110.807 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -38.69 90.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 2.28 111.1 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -43.37 26.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.305 -0.407 . . . . 1.21 111.421 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.477 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -66.24 -49.37 67.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.255 -0.429 . . . . 1.48 111.903 -179.178 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.32 31.14 2.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.972 0.415 . . . . 1.73 111.082 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.67 121.14 10.88 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.861 -0.609 . . . . 1.64 111.448 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.497 -0.763 . . . . 3.71 109.569 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.799 0.333 . . . . 2.52 110.531 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 288' ' ' ALA . . . . . 0.408 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -63.26 -47.36 82.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 1.96 111.345 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -44.36 -45.1 8.68 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 113.363 0.875 . . . . 1.33 113.363 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 290' ' ' ASN . . . . . 0.473 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.3 p-10 -90.72 -26.99 19.25 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.55 0.574 . . . . 1.17 112.55 -179.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 291' ' ' LEU . . . . . 0.527 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -68.93 -45.12 71.61 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 120.172 -0.611 . . . . 2.08 112.624 -178.449 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 292' ' ' TRP . . . . . 0.736 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 89.5 m95 -54.68 -51.5 78.17 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 118.809 0.731 . . . . 0.51 109.739 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 293' ' ' PRO . . . . . 0.553 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 36.0 Cg_exo -62.57 -18.35 63.19 Favored 'Trans proline' 0 C--N 1.363 1.321 0 C-N-CA 121.506 1.471 . . . . 0.76 112.326 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 294' ' ' SER . . . . . 0.548 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 61.6 m -58.74 -60.85 9.08 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 118.374 -0.822 . . . . 0.79 110.414 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 295' ' ' PRO . . . . . 0.651 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 35.2 Cg_exo -60.94 -29.7 88.54 Favored 'Trans proline' 0 C--N 1.373 1.829 0 CA-C-N 121.359 1.521 . . . . 0.85 110.562 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.14 -44.18 97.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.095 -0.706 . . . . 1.42 109.095 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 30.8 ttm -64.91 -35.91 82.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.373 -0.83 . . . . 1.82 109.072 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 298' ' ' ILE . . . . . 0.468 HG12 ' O ' ' B' ' 294' ' ' SER . 39.7 mm -61.72 -33.38 57.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.652 -0.703 . . . . 0.84 109.476 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -40.29 95.19 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 108.777 -0.823 . . . . 1.89 108.777 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.8 -44.69 84.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.482 -0.781 . . . . 2.86 109.34 178.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 18.2 m -64.41 -36.31 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.973 -0.558 . . . . 1.02 109.738 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -66.18 -33.38 75.62 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.901 -0.777 . . . . 2.62 108.901 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -69.26 -32.13 71.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 2.21 109.217 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -72.83 -46.09 54.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.472 -0.786 . . . . 2.06 110.009 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 116.396 -0.365 . . . . 2.05 110.029 179.37 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.854 0.359 . . . . 2.82 111.024 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.39 -45.59 90.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 2.61 111.163 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -33.72 72.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 1.78 111.481 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.6 mt -68.21 -43.09 85.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.013 0.435 . . . . 1.72 110.319 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -64.91 -47.63 77.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.661 -0.7 . . . . 2.53 110.488 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -68.73 -30.01 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.916 -0.583 . . . . 1.91 110.882 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.34 82.62 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.479 -0.328 . . . . 1.14 110.676 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.5 -38.96 75.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.034 0.445 . . . . 1.11 110.329 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -70.73 -35.5 72.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.911 -0.586 . . . . 2.28 110.526 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.464 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 98.2 t -72.49 -35.18 50.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.092 -0.504 . . . . 1.36 110.76 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -73.45 -39.05 65.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 1.31 110.09 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.677 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 25.5 t0 -80.7 103.87 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.646 -0.706 . . . . 0.95 110.776 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.464 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 2.5 mptt -94.63 -28.66 15.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.443 -0.344 . . . . 1.65 111.563 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.631 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.8 OUTLIER -77.32 -21.81 52.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.841 0.353 . . . . 1.36 111.028 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.7 57.55 4.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.032 -0.604 . . . . 1.08 113.391 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 19.8 p-10 -125.88 -1.11 7.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.046 0.451 . . . . 0.95 110.413 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.94 23.96 73.26 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.946 -0.645 . . . . 0.71 112.231 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.429 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 42.2 m-85 -142.8 139.46 30.97 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.188 0.518 . . . . 1.44 111.102 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.519 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 66.7 mt -93.03 99.34 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.113 -0.949 . . . . 1.18 109.705 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.2 t -81.9 163.87 21.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.899 -0.592 . . . . 1.48 110.126 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.38 90.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.86 110.818 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -32.88 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 1.01 110.993 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -74.49 -41.18 61.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.054 -0.521 . . . . 0.88 110.436 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.718 HD22 ' CH2' ' B' ' 292' ' ' TRP . 10.9 tp -65.52 -29.91 70.61 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.392 -0.367 . . . . 0.97 110.124 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -57.0 -56.34 23.06 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.149 -0.478 . . . . 2.51 110.107 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -58.08 -35.55 71.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.864 0.364 . . . . 1.44 111.472 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.77 -56.97 10.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.3 -0.409 . . . . 1.04 111.743 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.558 ' CE ' ' HA ' ' B' ' 292' ' ' TRP . 0.8 OUTLIER -72.5 -19.73 61.48 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.114 0.783 . . . . 1.88 113.114 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.7 p -78.64 -41.79 30.52 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.122 -0.631 . . . . 2.02 110.551 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -67.33 -23.11 65.59 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.378 0.609 . . . . 2.2 109.944 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.51 -35.51 74.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.019 -0.991 . . . . 1.67 110.337 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.01 -65.38 0.56 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.667 -0.778 . . . . 1.25 112.211 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -74.9 90.19 2.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.14 0.495 . . . . 2.09 110.75 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -83.02 104.97 13.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 2.24 110.681 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 83.3 mt -91.71 175.4 6.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.11 -0.495 . . . . 1.64 110.23 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.419 ' O ' HG22 ' A' ' 121' ' ' VAL . 40.6 p -76.5 166.34 23.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.703 0.287 . . . . 1.25 111.368 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.46 -37.87 70.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 1.99 110.685 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.28 -44.17 95.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.048 -0.524 . . . . 2.75 110.575 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 124' ' ' MET . 37.8 mt-10 -67.9 -37.31 81.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 1.14 110.336 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' A' ' 124' ' ' MET . 97.6 t -64.98 -41.45 92.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 N-CA-C 109.04 -0.726 . . . . 1.34 109.04 177.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.482 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.4 t70 -65.69 -44.26 86.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.87 -0.789 . . . . 1.38 108.87 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 127' ' ' GLU . 19.9 tt0 -53.01 -41.58 64.78 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.446 -0.797 . . . . 1.94 109.704 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' B' ' 292' ' ' TRP . 57.3 mtp -54.47 -51.0 66.41 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.07 -0.968 . . . . 1.08 110.852 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.469 ' HA ' ' HB2' ' A' ' 128' ' ' ALA . 0.2 OUTLIER -76.49 -22.49 15.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.251 -0.58 . . . . 1.33 111.002 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 59.3 mtm-85 -65.33 -37.08 85.99 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.35 -0.611 . . . . 1.97 109.35 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.533 ' OE1' ' HB1' ' B' ' 289' ' ' ALA . 12.8 pt-20 -92.41 -1.99 56.63 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 1.55 109.988 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.469 ' HB2' ' HA ' ' A' ' 125' ' ' ILE . . . -107.55 5.38 26.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.511 0.672 . . . . 0.82 109.682 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 31.9 t70 -115.66 125.51 52.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.11 -0.95 . . . . 0.8 109.708 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.72 -27.12 2.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.186 -0.461 . . . . 1.45 110.791 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.61 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.0 OUTLIER -78.52 -10.34 59.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.282 -0.417 . . . . 1.35 111.072 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.48 62.51 3.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.745 -0.74 . . . . 1.25 112.426 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.644 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.1 OUTLIER -135.1 -17.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.649 0.261 . . . . 1.13 110.81 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.93 -14.92 63.97 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.901 -0.666 . . . . 0.99 113.298 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -119.26 169.21 10.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 1.27 110.632 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.646 HG11 ' CH2' ' B' ' 292' ' ' TRP . 27.0 m -106.09 113.7 43.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.142 0.496 . . . . 1.81 109.87 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.506 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 25.4 p30 -92.21 -177.63 4.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.349 -0.612 . . . . 0.96 109.349 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.92 -57.04 12.45 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.986 0.365 . . . . 1.51 111.986 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -57.45 -46.95 83.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 1.84 111.766 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.506 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 32.7 mt-10 -61.79 -42.92 99.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.795 0.331 . . . . 0.74 110.511 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.15 -45.39 91.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.774 -0.648 . . . . 1.04 110.114 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 70.3 t -64.29 -49.94 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.427 -0.806 . . . . 1.36 111.689 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.69 -38.6 87.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.437 0.532 . . . . 2.28 112.437 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.477 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -70.4 -41.69 72.65 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.746 -0.382 . . . . 1.21 111.589 -179.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.503 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -74.99 -45.92 38.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.016 0.436 . . . . 1.48 111.006 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.43 77.88 1.68 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.205 -0.452 . . . . 1.73 110.749 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -91.72 126.77 36.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.123 -0.49 . . . . 1.64 110.721 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.24 -0.886 . . . . 3.71 109.784 179.775 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 109.072 -0.714 . . . . 2.52 109.072 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.42 ' HB1' ' HG2' ' A' ' 124' ' ' MET . . . -97.77 0.68 47.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.55 -0.75 . . . . 1.96 112.763 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . 0.533 ' HB1' ' OE1' ' A' ' 127' ' ' GLU . . . -32.23 -50.29 0.22 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.328 0.862 . . . . 1.33 113.328 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.524 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.9 p-10 -59.94 -24.29 64.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.64 0.257 . . . . 1.17 111.437 -179.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.591 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.3 tp -69.52 -25.17 63.9 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 109.332 -0.618 . . . . 2.08 109.332 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.718 ' CH2' HD22 ' A' ' 105' ' ' LEU . 53.5 m95 -60.88 -56.96 29.93 Favored Pre-proline 0 C--O 1.249 1.045 0 N-CA-C 106.976 -1.49 . . . . 0.51 106.976 176.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 50.2 Cg_exo -59.17 -17.85 41.08 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 121.268 1.312 . . . . 0.76 112.276 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.591 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 43.4 m -56.7 -64.73 2.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-O 118.288 -0.863 . . . . 0.79 110.923 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.558 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.4 Cg_exo -62.24 -26.49 77.53 Favored 'Trans proline' 0 C--N 1.372 1.79 0 CA-C-N 121.889 1.71 . . . . 0.85 110.62 176.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.8 tp -62.12 -44.42 96.67 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.583 0.706 . . . . 1.42 109.158 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 34.1 ttm -67.45 -32.88 74.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 1.82 108.923 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.507 HG12 ' O ' ' B' ' 294' ' ' SER . 40.7 mm -65.55 -32.48 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.211 -0.904 . . . . 0.84 109.191 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -45.18 94.46 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.89 -0.781 . . . . 1.89 108.89 177.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -66.68 -35.22 79.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.828 -0.624 . . . . 2.86 109.604 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 49.0 m -69.42 -36.74 76.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 1.02 109.736 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -66.98 -31.22 71.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 2.62 109.42 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -66.43 -42.48 87.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.691 -0.855 . . . . 2.21 108.691 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.43 -41.43 84.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.306 -0.861 . . . . 2.06 109.207 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 2.05 109.53 178.656 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.677 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.644 'CA ' ' OD1' ' A' ' 133' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.762 0.315 . . . . 2.82 111.237 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.82 -71.08 0.07 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.534 0.734 . . . . 2.61 112.659 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -63.14 -28.29 69.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 111.787 0.291 . . . . 1.78 111.787 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -64.94 -48.0 85.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.23 0.538 . . . . 1.72 109.667 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -70.6 -44.53 67.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.568 -0.742 . . . . 2.53 110.121 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.404 ' O ' HG23 ' A' ' 91' ' ' VAL . 42.1 mm-40 -61.02 -43.1 99.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.827 -0.624 . . . . 1.91 111.173 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.99 79.5 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.14 110.119 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -56.81 -41.37 77.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.627 -0.715 . . . . 1.11 110.64 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -68.13 -36.22 79.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.834 -0.621 . . . . 2.28 111.571 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.535 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 94.3 t -77.88 -35.83 21.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.821 0.343 . . . . 1.36 111.016 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -71.42 -33.14 69.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.504 -0.316 . . . . 1.31 110.813 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.681 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 30.1 t70 -82.9 90.01 6.91 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.607 -0.516 . . . . 0.95 109.607 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 4.6 mptt -91.64 -18.9 23.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 1.65 111.714 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.3 OUTLIER -79.46 -23.92 42.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.874 -0.33 . . . . 1.36 110.549 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.5 58.1 3.69 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.845 -0.693 . . . . 1.08 113.127 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.437 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 19.9 p-10 -126.67 -5.62 6.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.867 0.365 . . . . 0.95 110.295 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.96 17.15 77.67 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.847 -0.615 . . . . 0.71 112.751 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -143.89 139.11 29.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.703 0.287 . . . . 1.44 110.577 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.542 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 9.8 mt -84.76 103.12 11.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.541 -0.911 . . . . 1.18 108.541 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.485 ' HA ' ' HG2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -82.58 164.02 21.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.655 -0.702 . . . . 1.48 110.367 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -56.46 -44.41 80.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.86 111.044 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -41.33 96.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.045 0.45 . . . . 1.01 110.739 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.434 ' O ' HG22 ' A' ' 108' ' ' VAL . 47.7 mt-10 -67.49 -41.77 83.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.745 -0.662 . . . . 0.88 110.469 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.737 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 16.3 tp -67.31 -32.33 73.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.287 -0.415 . . . . 0.97 110.245 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.48 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 30.3 mtm-85 -57.97 -39.44 78.16 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.638 -0.504 . . . . 2.51 109.638 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -71.31 -33.48 69.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.519 . . . . 1.44 110.106 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.434 HG22 ' O ' ' A' ' 104' ' ' GLU . 96.0 t -62.15 -49.15 85.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.09 -0.505 . . . . 1.04 110.07 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.499 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.2 OUTLIER -66.26 -34.0 77.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 1.88 110.683 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.2 m -64.19 -45.72 87.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.912 0.386 . . . . 2.02 110.22 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -73.98 -24.25 59.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 2.2 110.26 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 17.8 tp -63.69 -31.77 73.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.673 -0.694 . . . . 1.67 110.302 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.01 -40.17 2.61 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.786 -0.721 . . . . 1.25 112.071 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.68 98.0 5.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 2.09 110.474 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -89.14 100.52 13.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 2.24 110.337 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.84 -174.29 2.5 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.818 -0.628 . . . . 1.64 110.824 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 43.8 p -78.19 165.17 24.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 1.25 110.722 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.48 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 18.9 t70 -63.79 -37.63 88.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.326 -0.397 . . . . 1.99 110.737 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -66.0 -31.85 72.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.134 -0.484 . . . . 2.75 110.386 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -67.38 -37.95 83.95 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.157 -0.683 . . . . 1.14 109.157 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.457 ' O ' ' HB2' ' A' ' 124' ' ' MET . 58.6 t -67.72 -36.33 75.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.638 -0.875 . . . . 1.34 108.638 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -65.87 -43.3 88.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.197 -0.91 . . . . 1.38 108.896 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -57.7 -38.84 75.89 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.802 -0.814 . . . . 1.94 108.802 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.705 ' SD ' HD22 ' B' ' 291' ' ' LEU . 38.8 mtp -58.18 -52.27 66.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.177 -0.92 . . . . 1.08 111.276 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.5 mm -68.67 -34.86 67.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 120.753 -0.379 . . . . 1.33 110.485 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -64.38 -29.65 70.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.947 0.403 . . . . 1.97 110.121 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.14 -27.08 24.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.531 -0.759 . . . . 1.55 110.664 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -89.31 -26.12 21.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.061 -0.518 . . . . 0.82 112.027 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.662 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 30.0 t0 -90.59 109.71 20.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.981 0.419 . . . . 0.8 109.967 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 6.1 mt -100.68 -31.43 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.875 -0.602 . . . . 1.45 111.134 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.61 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -75.56 -20.16 58.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.773 0.321 . . . . 1.35 111.447 -179.034 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.84 61.87 2.33 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.666 -0.778 . . . . 1.25 113.005 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.626 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.5 p-10 -121.72 -14.11 8.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.858 0.361 . . . . 1.13 110.269 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.67 -11.41 61.11 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.076 -0.583 . . . . 0.99 112.632 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.485 ' HG2' ' HA ' ' A' ' 101' ' ' SER . 16.5 mt-30 -132.29 165.35 24.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.329 0.585 . . . . 1.27 110.853 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.602 HG11 ' CH2' ' B' ' 292' ' ' TRP . 4.6 m -106.8 124.9 62.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.79 -0.819 . . . . 1.81 108.79 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.557 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.8 p30 -103.54 -178.46 3.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.442 -0.345 . . . . 0.96 110.348 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.447 ' O ' HG21 ' A' ' 142' ' ' VAL . 68.9 t80 -59.2 -44.18 92.23 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 111.914 0.339 . . . . 1.51 111.914 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -61.97 -46.08 90.85 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.698 0.285 . . . . 1.84 111.524 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.557 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 31.7 mt-10 -72.29 -32.24 66.43 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.123 0.487 . . . . 0.74 110.384 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.508 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 10.3 t80 -58.89 -52.73 64.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.351 -0.84 . . . . 1.04 111.56 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 138' ' ' TYR . 44.7 t -60.82 -36.48 71.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.488 . . . . 1.36 111.463 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.0 -25.76 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.41 . . . . 2.28 111.912 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.53 ' HE3' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -73.15 -56.46 5.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.075 0.464 . . . . 1.21 110.901 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.42 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 2.0 mpt? -68.46 -53.29 24.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.814 -0.63 . . . . 1.48 111.244 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 73.77 10.02 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.931 0.396 . . . . 1.73 110.956 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 65.98 6.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 1.64 110.908 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 41.0 mmtt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.697 -0.668 . . . . 3.71 110.287 -179.971 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 287' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 109.906 -0.405 . . . . 2.52 109.906 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.676 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -111.17 -28.76 8.14 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.861 0.689 . . . . 1.96 112.861 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.39 -33.95 9.99 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 1.33 112.54 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 21.5 p-10 -92.1 -30.68 15.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 111.967 0.358 . . . . 1.17 111.967 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.752 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 6.1 tp -72.79 -41.71 64.71 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 113.426 0.899 . . . . 2.08 113.426 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.737 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 77.0 m95 -56.61 -50.87 85.36 Favored Pre-proline 0 C--O 1.247 0.954 0 CA-C-N 119.918 1.236 . . . . 0.51 108.989 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 44.6 Cg_exo -60.53 -21.71 69.44 Favored 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 121.591 1.527 . . . . 0.76 111.877 176.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 66.6 m -55.84 -65.27 1.6 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-O 118.523 -0.751 . . . . 0.79 110.809 179.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.752 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 13.5 Cg_endo -60.02 -31.21 93.17 Favored 'Trans proline' 0 C--N 1.368 1.589 0 CA-C-N 121.345 1.516 . . . . 0.85 111.665 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -44.79 88.8 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.004 -0.678 . . . . 1.42 109.926 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 43.4 ttm -69.39 -35.37 75.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.115 -0.698 . . . . 1.82 109.115 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . . . . . . . . . 22.8 mm -65.62 -30.49 50.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.333 -0.849 . . . . 0.84 109.118 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -68.08 -39.03 82.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.076 -0.713 . . . . 1.89 109.076 178.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -65.17 -36.63 84.81 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.264 -1.013 . . . . 2.86 108.264 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 10.9 m -71.55 -32.63 68.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.013 -0.994 . . . . 1.02 109.291 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -69.2 -38.62 78.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.464 -0.939 . . . . 2.62 108.464 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -60.27 -42.43 95.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.307 -0.998 . . . . 2.21 108.307 177.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -62.54 -41.22 98.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.922 -1.035 . . . . 2.06 109.086 177.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.292 -0.867 . . . . 2.05 110.263 179.405 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.681 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.662 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.891 0.377 . . . . 2.82 110.583 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -58.35 8.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.864 -0.607 . . . . 2.61 111.495 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.46 -31.86 68.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.531 -0.304 . . . . 1.78 111.548 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -66.36 -42.7 91.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.923 0.392 . . . . 1.72 110.479 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -65.1 -41.09 95.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.395 0.617 . . . . 2.53 109.433 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -68.02 -39.85 83.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.691 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.44 -41.84 77.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.49 . . . . 1.14 111.024 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -57.77 -38.76 75.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.072 -0.513 . . . . 1.11 110.818 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -74.71 -40.02 61.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.183 -0.462 . . . . 2.28 111.006 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.25 -36.94 78.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 1.36 111.052 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -73.72 -40.03 63.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.41 . . . . 1.31 110.192 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.665 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 31.0 t70 -81.98 75.55 8.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.415 0.626 . . . . 0.95 110.175 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -77.74 -21.62 51.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.394 -0.821 . . . . 1.65 111.225 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.1 OUTLIER -77.97 -13.05 60.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.566 -0.288 . . . . 1.36 110.786 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 63.5 63.95 4.1 Favored Glycine 0 C--N 1.333 0.363 0 CA-C-N 115.925 -0.579 . . . . 1.08 112.962 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.571 HD22 ' HB2' ' A' ' 99' ' ' TYR . 0.4 OUTLIER -132.57 -8.62 3.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.871 0.367 . . . . 0.95 110.528 -179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.71 15.75 74.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.14 -0.552 . . . . 0.71 113.937 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.571 ' HB2' HD22 ' A' ' 97' ' ' ASN . 94.5 m-85 -144.76 133.62 22.45 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.422 0.611 . . . . 1.44 110.929 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.407 HD13 HG23 ' A' ' 100' ' ' ILE . 33.6 mt -81.99 112.58 20.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.839 -0.618 . . . . 1.18 109.62 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.5 p -95.67 172.97 7.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 1.48 110.166 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.88 92.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.659 0.266 . . . . 0.86 110.298 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.03 76.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 1.01 111.092 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.508 ' OE2' ' HA ' ' A' ' 93' ' ' ASP . 49.1 mt-10 -63.01 -36.83 84.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.987 -0.551 . . . . 0.88 111.166 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.726 HD23 ' CZ2' ' B' ' 292' ' ' TRP . 7.0 tp -76.73 -34.54 58.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.643 -0.253 . . . . 0.97 111.02 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.402 ' NE ' HG13 ' A' ' 121' ' ' VAL . 36.1 mtt180 -58.81 -37.31 76.12 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.705 -0.48 . . . . 2.51 109.705 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.0 -23.05 65.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.493 -0.776 . . . . 1.44 110.62 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.6 t -83.04 -47.35 18.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.929 -0.578 . . . . 1.04 110.564 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.6 mmt -66.27 -30.42 70.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.81 -0.632 . . . . 1.88 112.091 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -41.5 86.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.043 0.449 . . . . 2.02 110.247 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.77 -27.76 62.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.763 -0.653 . . . . 2.2 109.555 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.4 tp -63.3 -39.49 94.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.309 -0.859 . . . . 1.67 109.703 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.88 -31.16 4.85 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.63 -0.714 . . . . 1.25 111.608 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.0 93.07 7.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.373 0.606 . . . . 2.09 110.695 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -87.86 95.83 10.25 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.516 -0.766 . . . . 2.24 109.336 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.92 163.57 17.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.964 -0.562 . . . . 1.64 111.148 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.464 ' O ' HG22 ' A' ' 121' ' ' VAL . 41.7 p -81.24 169.35 17.43 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.836 -0.62 . . . . 1.25 110.05 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -36.03 70.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.875 0.369 . . . . 1.99 110.969 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.0 -46.72 76.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 2.75 110.421 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.03 -37.36 83.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.891 -0.595 . . . . 1.14 110.636 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 117' ' ' THR . 69.6 t -63.23 -32.25 55.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.954 0.407 . . . . 1.34 110.0 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.5 -53.0 61.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.028 -0.533 . . . . 1.38 109.784 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 126' ' ' ARG . 19.6 tt0 -67.75 -26.79 66.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.091 -0.504 . . . . 1.94 110.059 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.807 ' HE3' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -52.87 -53.76 44.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.712 -0.676 . . . . 1.08 110.746 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.441 HG22 ' O ' ' A' ' 125' ' ' ILE . 1.1 mt -89.36 -18.98 7.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.363 -0.535 . . . . 1.33 110.586 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.419 ' HB3' ' HA ' ' A' ' 123' ' ' GLU . 14.2 ttm180 -65.16 -35.47 81.2 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 108.916 -0.772 . . . . 1.97 108.916 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.406 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 7.0 tt0 -74.42 -16.32 60.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.952 -1.022 . . . . 1.55 109.19 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.63 31.81 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.19 -0.913 . . . . 0.82 110.594 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.643 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 21.1 t0 -112.36 112.95 24.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.401 0.619 . . . . 0.8 110.331 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mt -106.11 -36.78 3.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.358 -0.837 . . . . 1.45 110.817 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.42 -29.99 64.22 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.749 0.277 . . . . 1.35 111.749 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 93.46 21.95 27.98 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.543 -0.837 . . . . 1.25 112.367 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.619 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.6 p-10 -89.11 -9.32 51.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.903 0.383 . . . . 1.13 110.716 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.69 -2.74 85.29 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.955 -0.64 . . . . 0.99 112.944 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.57 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 12.6 mt-30 -120.38 169.76 10.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.959 0.409 . . . . 1.27 110.284 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.647 HG22 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -116.12 105.29 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.466 -0.788 . . . . 1.81 109.309 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.571 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.6 p30 -95.73 175.71 6.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.808 -0.633 . . . . 0.96 109.958 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.447 ' O ' HG21 ' A' ' 142' ' ' VAL . 50.2 t80 -51.61 -45.33 63.17 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.467 0.479 . . . . 1.51 111.624 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.79 -50.4 74.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.707 -0.679 . . . . 1.84 112.028 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.571 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 23.6 mt-10 -72.74 -32.8 65.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.076 0.465 . . . . 0.74 111.197 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.8 -53.17 59.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 1.04 112.085 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 138' ' ' TYR . 61.9 t -61.23 -40.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 111.961 0.356 . . . . 1.36 111.961 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -67.47 -28.44 67.86 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.197 -0.201 . . . . 2.28 111.485 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.406 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -64.2 -48.94 73.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.142 0.496 . . . . 1.21 110.907 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.436 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 1.9 mpt? -77.27 -36.42 54.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.952 -0.567 . . . . 1.48 111.25 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.7 55.92 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.235 0.541 . . . . 1.73 110.554 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.18 127.89 32.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.478 -0.783 . . . . 1.64 110.605 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.945 -0.57 . . . . 3.71 110.128 179.743 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 110.197 -0.297 . . . . 2.52 110.197 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.486 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -90.23 -30.56 17.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.905 0.383 . . . . 1.96 110.532 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -49.21 -39.0 28.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.202 -0.908 . . . . 1.33 112.686 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.44 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.0 p-10 -88.5 -22.96 23.36 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.013 0.375 . . . . 1.17 112.013 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' B' ' 294' ' ' SER . 6.9 tp -73.57 -43.27 60.23 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 118.739 -0.648 . . . . 2.08 111.878 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.807 ' CD1' ' HE3' ' A' ' 124' ' ' MET . 66.6 m95 -52.96 -52.47 64.89 Favored Pre-proline 0 CA--C 1.552 1.044 0 CA-C-N 119.262 0.937 . . . . 0.51 109.663 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.551 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 41.4 Cg_exo -60.33 -23.16 73.65 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.861 1.708 . . . . 0.76 112.028 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.544 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 50.9 m -55.93 -64.79 1.93 Allowed Pre-proline 0 CA--C 1.546 0.821 0 CA-C-O 118.355 -0.831 . . . . 0.79 110.834 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 51.5 Cg_exo -57.85 -31.74 93.22 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 121.572 1.597 . . . . 0.85 111.561 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.15 -46.16 91.69 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.195 0.522 . . . . 1.42 109.681 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 51.0 ttm -66.99 -39.1 87.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.799 -0.637 . . . . 1.82 109.47 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.51 HG12 ' O ' ' B' ' 294' ' ' SER . 30.7 mm -61.73 -32.43 53.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.734 . . . . 0.84 109.944 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -66.85 -45.97 76.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.06 -0.518 . . . . 1.89 110.246 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.82 -34.22 77.66 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.458 -0.571 . . . . 2.86 109.458 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 15.3 m -70.73 -34.78 72.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.573 -0.739 . . . . 1.02 109.197 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -69.98 -34.89 73.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.183 -0.673 . . . . 2.62 109.183 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -63.33 -40.08 96.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.388 -0.968 . . . . 2.21 108.388 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -69.13 -38.18 78.7 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.815 -1.084 . . . . 2.06 109.417 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-N 115.649 -0.705 . . . . 2.05 109.471 178.275 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.665 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.643 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 121.088 0.471 . . . . 2.82 110.862 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -53.93 -49.46 68.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.338 -0.846 . . . . 2.61 111.555 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.54 -44.57 89.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.769 0.318 . . . . 1.78 111.116 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.5 mt -62.74 -45.91 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 1.72 110.821 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -63.52 -43.91 95.79 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 2.53 110.047 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' O ' HG23 ' A' ' 91' ' ' VAL . 19.9 mm-40 -64.09 -42.35 96.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 1.91 110.841 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.95 81.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.306 -0.407 . . . . 1.14 110.146 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -59.85 -38.58 82.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.949 -0.569 . . . . 1.11 110.168 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -65.46 -37.26 86.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 2.28 110.911 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.3 t -75.96 -35.54 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.089 0.471 . . . . 1.36 110.706 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -71.42 -36.93 71.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 1.31 110.54 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.644 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 28.7 t70 -81.06 84.46 6.5 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.765 -0.457 . . . . 0.95 109.765 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -85.89 -22.8 27.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.563 -0.744 . . . . 1.65 112.142 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.621 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 4.6 p-10 -82.32 -11.0 58.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.977 0.418 . . . . 1.36 110.97 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.65 48.04 71.32 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.887 -0.597 . . . . 1.08 113.692 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -115.13 -6.1 12.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.99 0.395 . . . . 0.95 110.536 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 79.54 14.13 81.67 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.944 -0.646 . . . . 0.71 112.722 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -139.16 149.54 44.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.703 0.287 . . . . 1.44 110.747 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.433 HG23 HD11 ' A' ' 100' ' ' ILE . 6.0 mt -94.4 103.16 14.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.956 -0.757 . . . . 1.18 108.956 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -83.56 162.47 20.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.579 -0.737 . . . . 1.48 109.442 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.51 -36.13 73.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.004 0.43 . . . . 0.86 110.399 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.92 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 1.01 110.555 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.543 ' OE1' ' HA ' ' A' ' 93' ' ' ASP . 45.0 mt-10 -67.64 -40.37 84.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 0.88 110.825 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.757 HD23 ' CZ2' ' B' ' 292' ' ' TRP . 5.0 tp -75.12 -26.03 58.89 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.11 0.481 . . . . 0.97 110.258 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -68.09 -13.86 62.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.238 -0.653 . . . . 2.51 109.238 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -106.33 15.78 25.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.083 -0.962 . . . . 1.44 109.024 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 104' ' ' GLU . 74.7 t -120.04 -54.92 3.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.445 -0.798 . . . . 1.04 109.622 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.574 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -69.0 -12.39 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.381 -0.827 . . . . 1.88 111.301 -179.497 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -37.34 68.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.159 -0.682 . . . . 2.02 109.159 178.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -79.03 -16.74 56.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.953 -1.021 . . . . 2.2 109.115 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 109' ' ' MET . 45.5 tp -67.04 -17.24 64.81 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.06 -0.973 . . . . 1.67 109.825 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 104.29 -70.52 0.26 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.667 -0.697 . . . . 1.25 112.128 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -61.78 106.33 0.67 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.989 0.423 . . . . 2.09 111.158 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -100.29 91.45 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.023 -0.535 . . . . 2.24 109.795 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.2 mt -77.33 178.84 6.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.281 -0.872 . . . . 1.64 111.105 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -77.8 172.28 13.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.349 . . . . 1.25 111.699 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -56.09 -48.57 75.88 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.093 -0.503 . . . . 1.99 111.802 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -64.49 -35.06 79.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 2.75 111.055 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.81 -39.61 79.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.884 0.373 . . . . 1.14 110.081 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.489 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.8 t -68.65 -36.89 76.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.975 -0.75 . . . . 1.34 108.975 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.462 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 4.0 t70 -63.21 -47.71 81.37 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.454 -0.943 . . . . 1.38 108.454 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.572 ' HG2' ' NH2' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -56.49 -37.3 70.2 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.388 -0.824 . . . . 1.94 109.948 178.55 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.593 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 2.5 mtp -55.43 -50.26 70.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.278 -0.874 . . . . 1.08 111.29 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -79.49 -27.01 12.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.124 -0.63 . . . . 1.33 110.946 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.572 ' NH2' ' HG2' ' A' ' 123' ' ' GLU . 80.1 mtm-85 -63.84 -31.35 72.5 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 108.273 -1.01 . . . . 1.97 108.273 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -72.78 -29.38 63.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 114.861 -1.063 . . . . 1.55 109.459 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.42 -0.24 54.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.415 -0.812 . . . . 0.82 111.528 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 20.7 t0 -106.9 116.41 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.265 0.555 . . . . 0.8 110.5 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.4 mt -109.51 -32.15 2.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.779 -0.646 . . . . 1.45 110.725 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -77.79 -14.93 59.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.883 0.373 . . . . 1.35 110.826 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.2 30.87 64.48 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.039 -0.601 . . . . 1.25 112.259 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.615 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -89.67 -10.83 44.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.014 0.435 . . . . 1.13 110.378 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 -12.57 68.72 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.141 -0.552 . . . . 0.99 112.753 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.429 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 6.1 mt-30 -120.67 173.08 7.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 1.27 110.929 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.628 HG22 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -115.86 105.92 19.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.673 -0.694 . . . . 1.81 109.752 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.531 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 2.2 p30 -90.3 173.09 8.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.363 -0.381 . . . . 0.96 110.039 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -52.37 -44.89 65.51 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.308 0.38 . . . . 1.51 111.623 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -57.2 -55.11 38.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 1.84 111.199 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.531 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 33.8 mt-10 -64.72 -42.75 95.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.327 -0.397 . . . . 0.74 110.565 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.423 ' CD1' HD12 ' A' ' 100' ' ' ILE . 88.8 t80 -53.51 -58.0 8.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.647 -0.706 . . . . 1.04 111.436 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 65.1 t -65.81 -51.95 55.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.069 -0.514 . . . . 1.36 111.953 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -56.65 -42.82 79.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.724 0.638 . . . . 2.28 112.724 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.462 ' HE3' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -61.28 -41.3 96.71 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.945 0.35 . . . . 1.21 111.945 -179.008 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.486 ' HE3' ' HB3' ' B' ' 292' ' ' TRP . 10.1 mtt -81.25 -31.02 33.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.412 -0.358 . . . . 1.48 111.351 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.2 m -87.98 59.9 5.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.429 0.633 . . . . 1.73 110.596 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 137.14 36.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.448 -0.796 . . . . 1.64 110.237 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.094 -0.955 . . . . 3.71 109.974 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 109.92 -0.4 . . . . 2.52 109.92 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -116.9 -15.01 10.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.15 -0.477 . . . . 1.96 110.8 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -59.46 -18.84 43.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.399 -0.819 . . . . 1.33 112.594 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.401 ' ND2' HD13 ' B' ' 291' ' ' LEU . 13.7 p-10 -91.11 -32.03 16.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 120.822 0.344 . . . . 1.17 111.527 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 294' ' ' SER . 8.8 mp -70.09 -42.58 72.54 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 118.937 -0.554 . . . . 2.08 111.441 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.757 ' CZ2' HD23 ' A' ' 105' ' ' LEU . 65.5 m95 -53.48 -54.63 43.47 Favored Pre-proline 0 CA--C 1.555 1.165 0 CA-C-N 118.915 0.779 . . . . 0.51 110.387 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 43.6 Cg_exo -60.75 -20.11 64.32 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.822 1.681 . . . . 0.76 112.229 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.552 ' O ' HG12 ' B' ' 298' ' ' ILE . 73.9 m -58.5 -64.2 3.13 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.987 -1.006 . . . . 0.79 110.116 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.531 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 75.9 Cg_exo -54.57 -31.77 71.44 Favored 'Trans proline' 0 C--N 1.372 1.801 0 CA-C-N 121.978 1.742 . . . . 0.85 111.374 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.475 HD23 ' SD ' ' A' ' 145' ' ' MET . 6.0 tp -61.62 -48.11 82.36 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.592 0.711 . . . . 1.42 109.5 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 32.9 ttm -67.73 -30.21 69.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.625 -0.716 . . . . 1.82 109.232 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.552 HG12 ' O ' ' B' ' 294' ' ' SER . 40.2 mm -68.36 -28.72 41.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 108.886 -0.783 . . . . 0.84 108.886 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -39.95 92.0 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.992 -1.114 . . . . 1.89 107.992 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -66.2 -40.22 90.24 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.454 -0.794 . . . . 2.86 109.093 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 7.2 m -68.39 -36.22 78.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.407 -0.815 . . . . 1.02 109.551 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -69.47 -34.7 74.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.497 -0.774 . . . . 2.62 109.36 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -33.49 75.44 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.572 -0.899 . . . . 2.21 108.572 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -72.38 -46.56 54.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.301 -0.863 . . . . 2.06 109.498 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 N--CA 1.456 -0.145 0 CA-C-N 116.071 -0.513 . . . . 2.05 109.914 179.056 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.644 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.655 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.722 0.296 . . . . 2.82 110.472 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.48 -48.39 77.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.562 -0.29 . . . . 2.61 111.619 -178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.28 -43.07 92.56 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.771 0.286 . . . . 1.78 111.771 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 mt -66.2 -43.63 91.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.832 0.348 . . . . 1.72 110.796 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 86' ' ' ARG . 38.5 ttt-85 -62.62 -42.26 99.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.003 -0.544 . . . . 2.53 110.642 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' O ' HG23 ' A' ' 91' ' ' VAL . 70.9 tt0 -75.23 -33.09 61.3 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 1.91 111.167 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.61 -45.35 81.51 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.824 0.345 . . . . 1.14 110.427 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -60.56 -39.13 86.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.883 -0.599 . . . . 1.11 110.436 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.428 ' NH2' ' HA2' ' A' ' 96' ' ' GLY . 6.8 tpm_? -67.63 -31.32 71.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 2.28 110.771 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.1 t -78.53 -42.96 26.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 1.36 111.239 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.08 -40.76 82.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 1.31 110.91 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.67 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 32.5 t70 -79.78 76.93 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.044 -0.724 . . . . 0.95 109.044 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -71.07 -28.54 64.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.225 -0.898 . . . . 1.65 111.441 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.645 ' OD2' 'CA ' ' A' 1000 ' ' ' CA' . 0.0 OUTLIER -70.11 -24.17 63.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.78 -0.368 . . . . 1.36 110.473 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.428 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 71.3 58.42 5.54 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.063 -0.589 . . . . 1.08 113.856 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.456 ' HB3' ' OD1' ' A' ' 95' ' ' ASP . 14.9 p-10 -128.72 -8.12 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.234 0.54 . . . . 0.95 110.677 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.46 65.65 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.553 -0.832 . . . . 0.71 112.151 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.572 ' CE1' ' HB3' ' A' ' 137' ' ' ASN . 40.2 m-85 -140.38 124.87 17.89 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.586 0.232 . . . . 1.44 110.611 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.576 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 8.0 mt -79.03 102.79 5.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.917 -0.772 . . . . 1.18 108.917 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.3 m -77.55 161.95 27.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.51 -0.768 . . . . 1.48 110.408 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.95 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.422 . . . . 0.86 110.522 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.81 71.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 1.01 111.132 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -75.99 -41.56 50.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 0.88 110.388 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.712 HD12 ' CZ3' ' B' ' 292' ' ' TRP . 5.5 tp -74.63 -31.64 62.05 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.199 -0.455 . . . . 0.97 111.191 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.456 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 50.3 mtm-85 -57.16 -35.62 69.77 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.224 0.535 . . . . 2.51 110.041 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -69.53 -36.92 76.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.766 -0.652 . . . . 1.44 109.319 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.0 t -66.31 -41.15 88.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.427 -0.806 . . . . 1.04 109.792 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -27.12 69.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.062 0.458 . . . . 1.88 110.604 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 21.7 m -71.49 -35.11 70.68 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.317 0.579 . . . . 2.02 109.565 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -88.09 -3.04 58.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.659 -0.701 . . . . 2.2 109.856 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.8 tp -85.79 -0.49 55.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.296 -0.866 . . . . 1.67 110.13 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.31 -62.81 4.43 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.714 -0.675 . . . . 1.25 111.724 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -74.64 96.13 2.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.987 0.423 . . . . 2.09 110.615 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -81.02 99.35 8.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 2.24 109.917 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.7 mt -90.53 167.1 12.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.606 -0.725 . . . . 1.64 110.668 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.428 ' O ' HG22 ' A' ' 121' ' ' VAL . 41.4 p -73.06 166.19 23.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.347 -0.388 . . . . 1.25 110.909 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.456 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 27.9 t0 -57.91 -43.06 85.94 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.511 0.189 . . . . 1.99 111.511 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -62.45 -35.32 78.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.667 0.27 . . . . 2.75 110.546 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -69.36 -38.64 78.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.779 -0.452 . . . . 1.14 109.779 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 117' ' ' THR . 55.5 t -68.26 -36.88 76.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.907 -0.775 . . . . 1.34 108.907 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -64.02 -42.65 97.06 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.897 -0.779 . . . . 1.38 108.897 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.53 -34.51 77.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.252 -0.885 . . . . 1.94 109.186 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.519 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -61.21 -50.1 74.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 1.08 110.683 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.402 ' HA ' ' HZ2' ' B' ' 292' ' ' TRP . 0.7 OUTLIER -75.43 -24.38 17.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.771 -0.372 . . . . 1.33 110.388 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -66.78 -29.46 69.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.657 -0.868 . . . . 1.97 108.657 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -82.76 -20.7 35.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.826 -1.079 . . . . 1.55 109.558 178.513 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -99.91 -2.36 34.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.666 -0.697 . . . . 0.82 111.363 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.654 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 29.0 t70 -106.47 112.15 25.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.147 -0.479 . . . . 0.8 109.794 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mt -107.68 -22.47 4.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.131 -0.486 . . . . 1.45 111.229 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.62 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 3.2 p-10 -85.39 -13.43 49.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.808 0.337 . . . . 1.35 111.677 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.01 45.08 12.22 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.94 -0.648 . . . . 1.25 113.559 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.643 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.4 OUTLIER -112.45 -13.52 13.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.008 0.433 . . . . 1.13 110.301 179.369 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.47 -36.92 3.96 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.801 -0.714 . . . . 0.99 112.745 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -107.67 172.3 6.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.066 0.46 . . . . 1.27 110.894 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.647 HG11 ' CH2' ' B' ' 292' ' ' TRP . 17.0 m -107.73 118.59 55.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.206 -0.664 . . . . 1.81 109.206 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.572 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.1 p30 -92.83 177.2 6.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.669 -0.493 . . . . 0.96 109.669 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -50.19 -49.1 53.58 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 123.192 0.308 . . . . 1.51 111.783 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.91 -54.98 41.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 1.84 111.257 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.0 -42.73 98.98 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.391 -0.368 . . . . 0.74 111.007 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -53.54 -55.28 26.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.69 -0.686 . . . . 1.04 111.121 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 56.2 t -69.98 -41.1 79.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.979 -0.555 . . . . 1.36 111.892 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.76 -43.99 87.2 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.517 0.562 . . . . 2.28 112.517 -178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.419 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.4 tmt? -67.28 -45.24 77.2 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.862 0.319 . . . . 1.21 111.862 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.423 ' SD ' HD23 ' B' ' 296' ' ' LEU . 29.5 mtt -72.85 -50.89 21.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.235 -0.438 . . . . 1.48 111.844 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -90.01 50.47 1.88 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.46 0.648 . . . . 1.73 111.158 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.02 66.06 4.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.75 -0.659 . . . . 1.64 110.301 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.251 -0.881 . . . . 3.71 109.747 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.022 -0.362 . . . . 2.52 110.022 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.519 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -46.33 -40.51 11.92 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.604 0.565 . . . . 1.96 112.215 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -47.6 -45.4 27.46 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.837 0.711 . . . . 1.33 112.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -91.56 -22.71 20.2 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 112.307 0.484 . . . . 1.17 112.307 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.458 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 0.1 OUTLIER -68.76 -55.5 11.08 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 118.668 -0.682 . . . . 2.08 112.067 -178.539 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.712 ' CZ3' HD12 ' A' ' 105' ' ' LEU . 84.0 m95 -49.1 -52.48 47.39 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 118.867 0.758 . . . . 0.51 110.869 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 57.6 Cg_exo -56.69 -28.47 75.66 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 122.035 1.823 . . . . 0.76 112.901 178.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.498 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 38.1 m -56.35 -62.72 4.35 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-O 118.358 -0.83 . . . . 0.79 110.915 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.564 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 64.8 Cg_exo -55.14 -31.63 76.39 Favored 'Trans proline' 0 C--N 1.369 1.645 0 CA-C-N 121.297 1.499 . . . . 0.85 111.677 176.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.423 HD23 ' SD ' ' A' ' 145' ' ' MET . 10.4 tp -64.82 -42.88 94.62 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.546 0.689 . . . . 1.42 109.487 178.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 46.0 ttm -66.25 -31.04 71.61 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.399 -0.963 . . . . 1.82 108.399 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 294' ' ' SER . 38.6 mm -64.85 -30.51 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 115.135 -0.939 . . . . 0.84 109.537 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -39.05 87.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.235 -1.024 . . . . 1.89 108.235 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -61.38 -43.53 98.71 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.336 -0.987 . . . . 2.86 108.336 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.6 m -67.12 -34.69 78.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.594 -0.73 . . . . 1.02 110.133 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -68.78 -32.27 71.88 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.467 -0.568 . . . . 2.62 109.467 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -63.92 -36.46 84.03 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.747 -1.205 . . . . 2.21 107.747 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -66.63 -39.64 88.38 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.628 -1.169 . . . . 2.06 108.77 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-N 115.731 -0.668 . . . . 2.05 109.946 178.584 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.67 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.654 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 120.794 0.33 . . . . 2.82 110.772 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.39 -39.36 85.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.401 -0.363 . . . . 2.61 111.639 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.439 ' CD ' ' HZ1' ' B' ' 303' ' ' LYS . 0.8 OUTLIER -57.21 -43.73 83.04 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.024 0.44 . . . . 1.78 109.961 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.39 -46.2 81.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.496 -0.775 . . . . 1.72 110.983 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -63.25 -44.64 94.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.739 0.304 . . . . 2.53 110.773 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.445 ' O ' HG23 ' A' ' 91' ' ' VAL . 30.7 tt0 -65.03 -40.6 95.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.092 -0.504 . . . . 1.91 110.149 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.74 -46.68 81.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.631 -0.507 . . . . 1.14 109.631 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.08 -42.7 86.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.628 -0.715 . . . . 1.11 110.33 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -65.34 -42.97 92.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.838 -0.619 . . . . 2.28 111.162 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.511 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 89.8 t -68.33 -34.51 66.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.177 -0.465 . . . . 1.36 110.866 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.71 -38.16 64.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.33 -0.396 . . . . 1.31 110.126 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 32.0 t70 -82.48 81.59 8.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.362 0.601 . . . . 0.95 109.88 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.511 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 8.6 mttt -81.73 -15.9 52.89 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.507 -0.769 . . . . 1.65 111.766 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.2 OUTLIER -81.77 -26.74 34.19 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.603 -0.439 . . . . 1.36 110.473 -179.425 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.46 23.39 40.13 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.805 -0.712 . . . . 1.08 114.848 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 12.7 p-10 -96.92 -8.51 30.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.781 0.791 . . . . 0.95 111.127 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.05 20.8 66.8 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.772 -0.728 . . . . 0.71 112.334 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -144.62 130.67 19.43 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.888 -0.412 . . . . 1.44 109.888 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.589 ' O ' HG23 ' A' ' 136' ' ' VAL . 65.7 mt -76.44 102.21 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.163 -0.68 . . . . 1.18 109.163 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -81.27 165.72 21.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.12 -0.491 . . . . 1.48 109.692 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.59 68.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.802 0.334 . . . . 0.86 111.283 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.77 -42.41 70.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.072 0.463 . . . . 1.01 110.199 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.457 ' O ' HG23 ' A' ' 108' ' ' VAL . 41.4 mt-10 -70.16 -37.06 75.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.556 -0.747 . . . . 0.88 110.304 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.809 HD11 ' CH2' ' B' ' 292' ' ' TRP . 19.2 tp -67.88 -29.39 68.48 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.329 0.585 . . . . 0.97 109.782 178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -76.91 5.11 8.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.461 -0.79 . . . . 2.51 109.926 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -125.31 16.2 8.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.303 -0.862 . . . . 1.44 109.066 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 104' ' ' GLU . 94.0 t -120.59 -66.87 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.633 -0.712 . . . . 1.04 110.535 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.651 ' SD ' HD13 ' A' ' 105' ' ' LEU . 0.8 OUTLIER -67.77 -18.88 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.672 -0.695 . . . . 1.88 111.323 -178.788 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -45.88 51.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.653 0.74 . . . . 2.02 109.383 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.87 -25.29 65.45 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 114.972 -1.013 . . . . 2.2 109.389 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 109' ' ' MET . 11.6 tp -60.28 -25.59 65.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.865 -1.061 . . . . 1.67 110.554 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.98 -35.18 4.28 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.921 -0.657 . . . . 1.25 111.903 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -66.91 102.64 0.99 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.0 0.429 . . . . 2.09 111.001 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -85.2 85.51 7.46 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.897 -0.592 . . . . 2.24 109.901 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.0 mt -95.57 162.61 13.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.577 -0.738 . . . . 1.64 111.45 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 22.3 p -87.14 170.56 11.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.352 -0.84 . . . . 1.25 110.524 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -55.94 -42.7 76.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 1.99 110.921 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.55 -39.89 92.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.288 -0.415 . . . . 2.75 110.753 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.87 -37.23 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 1.14 110.248 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 124' ' ' MET . 56.1 t -67.19 -36.24 76.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.8 -0.815 . . . . 1.34 108.8 177.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 23.5 t70 -63.59 -43.12 97.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.34 -0.846 . . . . 1.38 109.395 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.11 -34.69 78.16 Favored 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 109.406 -0.59 . . . . 1.94 109.406 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.676 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 5.6 mtp -60.07 -50.77 72.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.565 -0.743 . . . . 1.08 110.499 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.584 ' CD1' HG21 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -75.45 -22.81 16.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.664 -0.414 . . . . 1.33 110.197 179.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 10.2 ttm180 -67.05 -23.6 65.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.289 -0.634 . . . . 1.97 109.289 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -92.55 -19.39 22.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.036 -0.984 . . . . 1.55 110.729 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -97.44 -41.22 8.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.893 0.331 . . . . 0.82 111.893 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.645 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 19.6 t0 -79.87 106.99 12.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.22 0.534 . . . . 0.8 110.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -99.64 -34.09 4.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.565 -0.743 . . . . 1.45 110.972 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -74.55 -23.59 58.81 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.631 0.253 . . . . 1.35 111.242 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.04 29.4 34.31 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.77 -0.729 . . . . 1.25 112.743 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.632 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.4 p-10 -84.92 -20.3 30.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.901 0.381 . . . . 1.13 110.32 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.03 -7.9 59.04 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 121.031 -0.604 . . . . 0.99 112.943 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -128.26 163.71 24.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.392 0.615 . . . . 1.27 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.672 HG11 ' CZ3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -99.73 101.15 11.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.188 -0.915 . . . . 1.81 108.826 178.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -86.34 171.61 11.06 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.768 -0.373 . . . . 0.96 110.579 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -51.71 -50.41 60.57 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.498 0.499 . . . . 1.51 111.957 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.67 -55.03 39.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.604 -0.271 . . . . 1.84 111.463 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.55 -43.45 97.21 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.816 0.341 . . . . 0.74 110.547 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -55.03 -54.26 45.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.603 -0.726 . . . . 1.04 111.178 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 89.9 t -70.16 -43.89 78.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 1.36 112.045 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -63.35 -44.0 96.09 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.333 0.494 . . . . 2.28 112.333 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.511 ' HE2' ' CD1' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -68.78 -44.75 72.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.804 0.298 . . . . 1.21 111.804 -178.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 34.9 mtt -71.95 -47.7 50.46 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.993 0.368 . . . . 1.48 111.993 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 47.62 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.379 0.609 . . . . 1.73 110.527 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.59 130.27 41.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.424 -0.807 . . . . 1.64 110.268 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.188 -0.911 . . . . 3.71 109.843 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.854 0.359 . . . . 2.52 110.42 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.676 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -134.84 -10.29 2.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 1.96 111.168 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -56.39 -21.94 28.18 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 115.754 -0.657 . . . . 1.33 112.092 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.432 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 12.5 p-10 -92.0 -29.45 16.6 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.038 0.447 . . . . 1.17 111.315 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.577 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -72.21 -41.24 67.14 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-O 118.552 -0.737 . . . . 2.08 112.946 -177.685 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.809 ' CH2' HD11 ' A' ' 105' ' ' LEU . 66.0 m95 -57.73 -50.7 86.67 Favored Pre-proline 0 C--O 1.246 0.882 0 CA-C-N 119.546 1.066 . . . . 0.51 109.179 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.56 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 52.3 Cg_exo -58.34 -21.24 51.99 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.481 1.454 . . . . 0.76 111.735 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.577 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 69.4 m -57.63 -63.47 3.75 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-O 118.08 -0.962 . . . . 0.79 110.102 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.61 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 74.3 Cg_exo -55.72 -29.95 73.59 Favored 'Trans proline' 0 C--N 1.376 2.009 0 CA-C-N 121.815 1.684 . . . . 0.85 111.361 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 tp -65.25 -44.18 88.97 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.328 0.585 . . . . 1.42 109.763 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 69.2 mtm -68.17 -31.23 70.63 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.235 -1.024 . . . . 1.82 108.235 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.48 HG12 ' O ' ' B' ' 294' ' ' SER . 38.1 mm -66.84 -28.94 44.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 N-CA-C 108.752 -0.833 . . . . 0.84 108.752 177.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -42.41 93.06 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.565 -0.902 . . . . 1.89 108.565 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -70.53 -35.76 73.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.632 -0.713 . . . . 2.86 109.507 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 13.6 m -67.52 -44.9 77.27 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.407 -0.59 . . . . 1.02 109.407 178.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' B' ' 298' ' ' ILE . 0.1 OUTLIER -64.22 -36.24 83.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.592 -0.731 . . . . 2.62 109.237 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . 0.439 ' HZ1' ' CD ' ' A' ' 84' ' ' GLU . 23.6 tttp -58.12 -44.31 87.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.644 -0.707 . . . . 2.21 109.462 178.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -68.59 -44.92 73.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.808 . . . . 2.06 109.982 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 2.05 110.538 179.358 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.655 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.645 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 120.619 0.247 . . . . 2.82 111.52 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.407 ' H ' ' CD ' ' A' ' 83' ' ' GLU . 1.5 mp0 -61.73 -55.35 31.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.819 0.343 . . . . 2.61 110.846 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.2 -34.66 73.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 1.78 110.502 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.4 -46.73 89.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.989 -0.55 . . . . 1.72 110.829 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -59.09 -44.22 91.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.108 -0.496 . . . . 2.53 110.576 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.485 ' CD ' ' HZ1' ' B' ' 299' ' ' LYS . 1.0 OUTLIER -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.813 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.73 80.75 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.136 0.493 . . . . 1.14 109.982 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -62.02 -38.72 89.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.241 -0.89 . . . . 1.11 110.163 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -71.86 -27.8 63.12 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.79 -0.641 . . . . 2.28 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.8 t -83.13 -45.04 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.378 -0.373 . . . . 1.36 111.258 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -66.69 -32.64 74.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.3 -0.409 . . . . 1.31 110.994 -179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.663 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 25.9 t0 -83.73 91.42 7.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.91 -0.774 . . . . 0.95 108.91 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -85.27 -33.28 22.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.831 -0.622 . . . . 1.65 112.116 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.634 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.8 OUTLIER -69.14 -29.27 67.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.678 -0.409 . . . . 1.36 110.293 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.86 28.28 26.62 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.011 -0.614 . . . . 1.08 114.267 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.476 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 20.0 p-10 -90.8 -8.22 50.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 117.729 0.764 . . . . 0.95 110.781 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.0 17.5 61.15 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.831 -0.699 . . . . 0.71 111.728 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.432 ' HB2' HD22 ' A' ' 97' ' ' ASN . 98.6 m-85 -144.54 145.32 31.77 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.76 0.314 . . . . 1.44 110.346 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.596 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 38.1 mt -90.85 100.81 11.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.954 -0.566 . . . . 1.18 109.65 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -79.35 163.19 25.06 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 1.48 110.442 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.02 -43.01 81.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 0.86 110.093 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.08 91.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.871 -0.604 . . . . 1.01 110.839 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.412 ' O ' HG22 ' A' ' 108' ' ' VAL . 45.5 mt-10 -69.46 -37.83 77.49 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.537 -0.756 . . . . 0.88 111.036 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.7 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 10.1 tp -72.92 -29.79 63.4 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.766 0.317 . . . . 0.97 110.4 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.464 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 31.0 mtm-85 -61.31 -32.68 72.54 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.013 0.435 . . . . 2.51 110.306 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -82.26 -6.45 59.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.495 0.664 . . . . 1.44 110.686 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 104' ' ' GLU . 85.6 t -92.54 -51.82 10.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.902 -0.59 . . . . 1.04 110.288 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.548 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -69.22 -16.91 63.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.756 -0.656 . . . . 1.88 112.151 -178.69 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.41 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 0.4 OUTLIER -72.1 -35.84 69.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.934 0.397 . . . . 2.02 109.969 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -76.54 -20.47 56.84 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.675 -0.693 . . . . 2.2 109.864 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.3 tp -71.96 -10.75 60.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.219 -0.901 . . . . 1.67 110.508 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 92.62 -42.72 2.66 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.797 -0.716 . . . . 1.25 111.342 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.02 75.69 5.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 2.09 110.148 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 57.3 mttp -73.66 113.02 10.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.441 -0.8 . . . . 2.24 110.545 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.97 179.85 4.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.912 -0.586 . . . . 1.64 110.06 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.3 p -87.32 171.09 10.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.475 -0.33 . . . . 1.25 110.845 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.464 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 25.1 t0 -59.19 -42.39 90.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.327 -0.397 . . . . 1.99 111.443 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -42.4 99.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.751 0.31 . . . . 2.75 110.534 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -65.02 -37.79 88.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 1.14 110.326 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 61.9 t -69.47 -40.86 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.724 -0.473 . . . . 1.34 109.724 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.47 -40.03 94.93 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.502 -0.555 . . . . 1.38 109.502 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -64.78 -34.0 77.31 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 109.161 -0.681 . . . . 1.94 109.161 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.494 ' CE ' ' HE2' ' A' ' 109' ' ' MET . 8.0 mtp -60.87 -45.92 92.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 1.08 110.006 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.454 ' HA ' ' HB2' ' A' ' 128' ' ' ALA . 0.4 OUTLIER -77.79 -19.78 13.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.593 -0.443 . . . . 1.33 109.832 179.14 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -68.99 -30.25 68.62 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.11 -1.07 . . . . 1.97 108.11 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -88.36 -11.19 46.96 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.422 -1.263 . . . . 1.55 109.206 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB2' ' HA ' ' A' ' 125' ' ' ILE . . . -109.23 1.27 20.12 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.594 -0.73 . . . . 0.82 112.11 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 26.0 t0 -115.17 129.06 56.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.633 -0.506 . . . . 0.8 109.633 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.93 -33.59 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.255 -0.43 . . . . 1.45 111.132 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.639 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.4 p-10 -69.96 -25.3 63.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.874 0.369 . . . . 1.35 111.11 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.49 64.84 1.32 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.467 -0.873 . . . . 1.25 111.795 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.632 ' OD2' 'CA ' ' A' 1001 ' ' ' CA' . 0.7 OUTLIER -131.45 -18.27 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.679 0.276 . . . . 1.13 110.793 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.47 -25.86 26.74 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.577 -0.82 . . . . 0.99 113.065 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -116.44 176.1 5.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 1.27 110.216 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.684 HG11 ' CH2' ' B' ' 292' ' ' TRP . 30.0 m -106.82 122.01 60.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 1.81 108.692 178.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.404 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 28.7 p30 -94.57 -177.99 4.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.426 -0.352 . . . . 0.96 110.17 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -55.92 -49.25 73.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.793 0.33 . . . . 1.51 111.694 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.73 -54.09 49.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.106 -0.497 . . . . 1.84 111.632 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.404 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 41.2 mt-10 -61.76 -39.69 92.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.341 -0.39 . . . . 0.74 111.758 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -56.39 -58.62 7.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 1.04 111.376 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 22.6 t -65.87 -37.06 79.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.224 -0.443 . . . . 1.36 111.366 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -62.54 -44.18 96.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 2.28 111.582 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -45.14 65.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.883 0.373 . . . . 1.21 110.796 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.409 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -62.42 -39.3 92.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.098 -0.501 . . . . 1.48 111.659 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.57 37.52 2.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.104 0.478 . . . . 1.73 110.776 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.92 81.7 8.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.151 -0.477 . . . . 1.64 111.006 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.389 -0.815 . . . . 3.71 109.538 179.489 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.821 0.343 . . . . 2.52 110.591 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.96 -41.77 97.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 1.96 111.566 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -45.77 -41.83 11.32 Favored 'General case' 0 C--O 1.223 -0.335 0 O-C-N 123.966 0.791 . . . . 1.33 113.032 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -90.73 -27.93 18.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.876 -0.33 . . . . 1.17 111.885 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.554 ' O ' ' HB2' ' B' ' 294' ' ' SER . 2.5 tp -73.53 -44.85 56.65 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 113.004 0.742 . . . . 2.08 113.004 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.7 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 69.1 m95 -54.26 -53.66 56.58 Favored Pre-proline 0 CA--C 1.551 1.004 0 CA-C-N 119.534 1.061 . . . . 0.51 109.526 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 42.9 Cg_exo -61.35 -20.82 69.87 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 121.637 1.558 . . . . 0.76 112.428 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.573 ' O ' HG12 ' B' ' 298' ' ' ILE . 43.4 m -55.97 -64.79 1.95 Allowed Pre-proline 0 CA--C 1.544 0.73 0 CA-C-O 118.381 -0.819 . . . . 0.79 110.375 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.565 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 46.0 Cg_exo -59.24 -31.23 94.83 Favored 'Trans proline' 0 C--N 1.37 1.689 0 CA-C-N 121.494 1.569 . . . . 0.85 111.234 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.5 -46.39 90.29 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.186 0.517 . . . . 1.42 109.871 178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 41.6 ttm -68.33 -31.82 71.49 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.361 -0.607 . . . . 1.82 109.361 178.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.573 HG12 ' O ' ' B' ' 294' ' ' SER . 43.4 mm -62.01 -34.97 65.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.856 -0.794 . . . . 0.84 108.856 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . 0.485 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 2.6 tttp -66.39 -40.92 89.95 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.765 -0.652 . . . . 1.89 109.85 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -61.34 -42.62 98.98 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.886 -0.783 . . . . 2.86 108.886 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 301' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' B' ' 304' ' ' ASN . 6.4 m -70.55 -30.13 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.563 -0.744 . . . . 1.02 109.858 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 5.6 tptp -67.68 -33.75 75.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.172 -0.677 . . . . 2.62 109.172 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -65.81 -37.59 86.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.205 -1.035 . . . . 2.21 108.205 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' B' ' 301' ' ' SER . 22.6 t30 -63.86 -41.15 97.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.76 -1.109 . . . . 2.06 108.792 177.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.581 -0.736 . . . . 2.05 109.602 178.202 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.663 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.64 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 120.693 0.282 . . . . 2.82 111.198 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.43 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -55.2 -42.71 73.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.762 -0.654 . . . . 2.61 112.019 -178.637 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.425 ' CD ' ' HZ2' ' B' ' 303' ' ' LYS . 1.6 mp0 -53.47 -44.58 69.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.183 0.438 . . . . 1.78 112.183 -178.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.457 ' HA ' HD12 ' B' ' 296' ' ' LEU . 2.4 mt -65.25 -41.43 91.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.993 0.425 . . . . 1.72 111.188 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -68.79 -43.79 74.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.055 -0.52 . . . . 2.53 110.827 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 mm-40 -70.79 -35.04 72.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.86 -0.609 . . . . 1.91 112.063 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.26 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.747 0.308 . . . . 1.14 110.756 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -59.19 -42.06 89.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.554 . . . . 1.11 110.377 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.06 -29.79 66.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.903 -0.59 . . . . 2.28 110.536 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.46 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 57.9 t -74.71 -41.09 47.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 1.36 110.438 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -71.89 -37.25 70.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.069 -0.514 . . . . 1.31 110.791 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.674 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 21.2 t0 -83.68 104.89 14.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.658 -0.497 . . . . 0.95 109.658 178.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.46 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 5.2 mptt -91.43 -39.29 12.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.089 -0.505 . . . . 1.65 111.224 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 1.1 p-10 -69.48 -20.61 63.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.17 -0.468 . . . . 1.36 110.807 -178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.79 68.81 1.54 Allowed Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.153 -0.546 . . . . 1.08 112.774 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.497 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 24.2 p-10 -137.05 -0.41 2.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.891 0.377 . . . . 0.95 110.513 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.97 22.0 72.65 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.656 -0.783 . . . . 0.71 111.73 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.497 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 57.6 m-85 -142.82 122.86 13.63 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.688 0.28 . . . . 1.44 110.773 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.716 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 60.2 mt -82.13 102.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.712 -0.847 . . . . 1.18 108.712 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.6 t -76.32 163.29 27.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.592 -0.522 . . . . 1.48 109.592 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.5 -39.05 75.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.996 0.427 . . . . 0.86 110.459 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.91 88.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 1.01 110.508 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.71 -32.52 72.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.819 -0.628 . . . . 0.88 110.692 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.8 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 10.4 tp -77.27 -34.93 55.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.263 -0.426 . . . . 0.97 110.11 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 19.0 mtm180 -60.01 -34.22 73.05 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.515 -0.55 . . . . 2.51 109.515 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.09 -28.12 68.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.44 -0.8 . . . . 1.44 109.674 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.5 -35.33 44.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 1.04 109.998 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -34.77 73.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.214 -0.448 . . . . 1.88 110.345 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 m -63.8 -36.73 84.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.903 -0.589 . . . . 2.02 110.886 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -84.74 -27.34 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.145 0.498 . . . . 2.2 109.952 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.84 -27.98 67.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.69 -0.686 . . . . 1.67 109.979 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.03 -49.77 0.86 Allowed Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.801 -0.636 . . . . 1.25 111.685 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.48 100.16 8.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.068 0.461 . . . . 2.09 110.019 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -82.88 82.49 8.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.737 -0.665 . . . . 2.24 109.816 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.1 mt -72.54 166.66 22.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.689 -0.687 . . . . 1.64 111.691 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.4 p -77.4 168.67 19.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 1.25 111.095 -179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.18 -37.14 74.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.12 -0.491 . . . . 1.99 111.199 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -68.36 -37.36 80.38 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.894 0.378 . . . . 2.75 110.412 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -71.68 -34.28 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.784 -0.45 . . . . 1.14 109.784 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 124' ' ' MET . 77.0 t -67.78 -36.8 77.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.409 -0.96 . . . . 1.34 108.409 177.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 12.6 t70 -63.51 -41.99 98.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.131 -0.94 . . . . 1.38 108.572 177.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -60.65 -37.01 80.1 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.811 -0.631 . . . . 1.94 109.468 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.621 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 9.3 mtp -56.72 -51.46 68.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.218 -0.901 . . . . 1.08 111.777 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.56 ' CG2' HG21 ' A' ' 136' ' ' VAL . 1.4 mt -85.45 -14.07 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 119.077 -1.049 . . . . 1.33 111.382 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 20.0 ttm180 -68.11 -25.26 65.22 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.824 -1.176 . . . . 1.97 107.824 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -97.5 -5.44 35.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 113.898 -1.501 . . . . 1.55 109.605 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -101.85 -44.59 5.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.16 -0.473 . . . . 0.82 111.733 -178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 28.6 t70 -76.59 132.38 39.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.083 0.468 . . . . 0.8 111.179 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 37.4 mt -130.29 -23.59 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.799 -0.637 . . . . 1.45 110.893 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.611 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.1 p-10 -77.03 -22.4 53.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.426 -0.352 . . . . 1.35 111.828 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 98.62 -0.21 58.01 Favored Glycine 0 C--O 1.236 0.28 0 C-N-CA 120.434 -0.889 . . . . 1.25 113.699 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.1 OUTLIER -70.49 -24.68 62.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.277 0.538 . . . . 1.13 110.078 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.73 -8.17 59.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.852 -0.689 . . . . 0.99 113.461 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -123.89 -179.63 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.557 0.694 . . . . 1.27 111.169 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.716 ' CG2' ' HB ' ' A' ' 100' ' ' ILE . 0.0 OUTLIER -102.89 96.61 4.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 114.644 -1.162 . . . . 1.81 109.165 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.424 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 27.7 p30 -88.71 176.01 7.27 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.48 -0.488 . . . . 0.96 109.933 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -52.85 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.627 0.603 . . . . 1.51 112.627 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 30.5 mp0 -62.59 -50.82 69.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.457 -0.338 . . . . 1.84 111.776 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.424 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 39.4 mt-10 -62.67 -41.97 99.37 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.913 0.387 . . . . 0.74 110.706 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.426 ' HE2' ' O ' ' A' ' 85' ' ' ILE . 75.4 t80 -56.03 -56.25 23.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.535 -0.757 . . . . 1.04 111.365 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.42 -38.28 81.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.083 -0.508 . . . . 1.36 111.447 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.6 -41.52 92.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 2.28 111.429 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.608 ' HE2' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -74.71 -38.94 62.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.039 0.447 . . . . 1.21 110.913 -179.612 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.585 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -67.46 -47.64 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.495 . . . . 1.48 110.901 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.64 48.68 1.02 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.226 0.536 . . . . 1.73 109.895 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.45 101.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.671 -0.695 . . . . 1.64 110.804 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.308 -0.853 . . . . 3.71 109.833 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . 0.419 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.723 0.297 . . . . 2.52 110.23 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.621 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -114.96 -33.9 5.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.254 -0.43 . . . . 1.96 111.178 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.33 -30.37 4.84 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 123.914 0.759 . . . . 1.33 112.344 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.476 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 20.3 p-10 -92.79 -34.18 13.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.302 0.482 . . . . 1.17 112.302 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.472 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 9.6 mp -68.79 -46.66 68.14 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-O 118.3 -0.857 . . . . 2.08 112.724 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.8 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 59.8 m95 -52.98 -50.9 79.33 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-N 119.738 1.153 . . . . 0.51 109.927 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.56 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -64.01 -17.48 59.95 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 121.631 1.554 . . . . 0.76 112.385 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.544 ' O ' HG12 ' B' ' 298' ' ' ILE . 74.2 m -60.32 -61.52 7.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-O 118.547 -0.739 . . . . 0.79 110.289 178.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -60.88 -27.47 84.85 Favored 'Trans proline' 0 C--N 1.37 1.673 0 CA-C-N 121.481 1.565 . . . . 0.85 110.19 176.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 85' ' ' ILE . 4.4 tp -59.49 -47.74 84.33 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.041 -0.725 . . . . 1.42 109.041 177.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 50.3 ttm -67.33 -32.44 73.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.753 -0.658 . . . . 1.82 109.265 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.544 HG12 ' O ' ' B' ' 294' ' ' SER . 45.2 mm -65.66 -31.46 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.63 -0.714 . . . . 0.84 109.108 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -38.0 87.68 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.977 -1.12 . . . . 1.89 107.977 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' B' ' 303' ' ' LYS . 0.4 OUTLIER -65.36 -35.94 82.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.244 -0.889 . . . . 2.86 108.733 177.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.4 m -69.83 -36.43 75.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.659 -0.867 . . . . 1.02 108.659 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.5 tptp -67.75 -31.34 71.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.902 -0.777 . . . . 2.62 108.902 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . 0.425 ' HZ2' ' CD ' ' A' ' 84' ' ' GLU . 17.9 tttp -63.52 -43.73 96.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.214 -0.903 . . . . 2.21 108.794 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -69.49 -37.36 77.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.374 -0.83 . . . . 2.06 109.137 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.711 -0.677 . . . . 2.05 109.403 178.06 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.674 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.624 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 121.093 0.473 . . . . 2.82 110.709 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -29.94 70.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.674 . . . . 2.61 110.313 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -57.54 -47.66 81.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.417 -0.811 . . . . 1.78 110.516 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.0 mt -72.02 -32.43 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.672 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -65.3 -45.79 82.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.116 -0.493 . . . . 2.53 110.157 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.48 ' O ' HG23 ' A' ' 91' ' ' VAL . 3.3 tt0 -66.62 -38.21 86.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 1.91 109.818 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.39 82.08 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.002 -0.544 . . . . 1.14 110.41 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.81 -40.9 89.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 1.11 110.407 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -66.33 -36.62 83.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.869 -0.605 . . . . 2.28 110.737 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 87' ' ' GLU . 58.6 t -71.84 -36.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.175 -0.466 . . . . 1.36 110.472 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -66.44 -54.03 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.476 . . . . 1.31 110.052 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.658 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 23.4 t0 -83.89 96.68 8.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.95 110.014 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -90.65 -34.6 15.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.71 -0.677 . . . . 1.65 111.63 -178.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.671 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 1.1 p-10 -68.72 -25.64 64.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.839 0.352 . . . . 1.36 110.7 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.28 44.02 7.19 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.853 -0.689 . . . . 1.08 113.121 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.571 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 4.8 p-10 -97.1 -7.56 32.38 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.731 -0.47 . . . . 0.95 109.731 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.2 0.7 76.71 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.848 -0.614 . . . . 0.71 113.576 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.408 ' HB2' HD22 ' A' ' 97' ' ' ASN . 71.3 m-85 -141.09 155.33 46.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.88 0.371 . . . . 1.44 110.639 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.64 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 84.9 mt -83.67 100.48 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.89 -0.781 . . . . 1.18 108.89 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -72.51 155.45 40.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.432 -0.349 . . . . 1.48 110.426 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.57 -35.81 75.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.119 0.485 . . . . 0.86 110.229 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.18 -37.89 81.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 1.01 109.972 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.51 -30.41 61.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.664 -0.698 . . . . 0.88 110.142 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.754 HD11 ' CH2' ' B' ' 292' ' ' TRP . 18.8 tp -72.15 -40.64 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.859 -0.609 . . . . 0.97 109.954 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.492 ' HG2' ' CG1' ' A' ' 121' ' ' VAL . 20.3 mtm180 -57.61 -33.35 68.14 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.466 -0.334 . . . . 2.51 110.586 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.795 -0.639 . . . . 1.44 109.744 179.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.43 -40.82 78.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.724 -0.671 . . . . 1.04 110.403 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.611 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -61.12 -46.95 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.939 -0.573 . . . . 1.88 111.049 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.7 p -70.57 -32.58 70.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.885 0.374 . . . . 2.02 111.157 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -71.03 -28.16 64.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.285 -0.416 . . . . 2.2 110.156 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 51.7 tp -64.69 -29.56 70.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.82 -0.627 . . . . 1.67 110.465 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 111.3 -41.72 2.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.854 -0.688 . . . . 1.25 111.701 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -74.07 100.49 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.28 0.562 . . . . 2.09 109.784 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -81.87 123.13 28.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.509 -0.768 . . . . 2.24 111.268 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.0 mt -118.45 162.56 18.14 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.727 -0.67 . . . . 1.64 109.698 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 121' ' ' VAL . 26.6 p -75.07 168.22 20.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.992 -0.373 . . . . 1.25 109.992 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.3 -36.5 75.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.947 0.403 . . . . 1.99 110.249 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.01 -45.03 83.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.712 -0.677 . . . . 2.75 110.155 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.75 -38.41 86.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 1.14 110.708 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.541 ' O ' ' HB2' ' A' ' 124' ' ' MET . 85.1 t -67.12 -40.89 86.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.481 -0.563 . . . . 1.34 109.481 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 21.3 t70 -64.5 -40.07 94.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.046 -0.724 . . . . 1.38 109.046 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.04 -35.24 74.68 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.563 -0.532 . . . . 1.94 109.563 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.604 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -55.86 -45.08 78.59 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 1.08 109.763 178.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.663 ' CD1' HG21 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -81.05 -27.82 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.845 -0.616 . . . . 1.33 111.202 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 44.2 mtm-85 -68.92 -19.93 64.21 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.451 0.643 . . . . 1.97 109.663 178.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.17 -13.28 26.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.056 -0.975 . . . . 1.55 109.876 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -102.44 -35.82 8.64 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.736 -0.666 . . . . 0.82 111.572 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.647 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 27.0 t0 -83.47 104.87 13.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.936 0.398 . . . . 0.8 110.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.66 -32.4 3.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.854 -0.612 . . . . 1.45 111.303 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.626 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -74.8 -12.93 60.51 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 1.35 111.375 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 69.53 61.02 4.68 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.102 -0.57 . . . . 1.25 112.538 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.619 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.9 OUTLIER -118.46 -19.85 8.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.552 0.215 . . . . 1.13 110.669 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.27 -22.46 32.86 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.669 -0.777 . . . . 0.99 112.941 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -122.81 173.29 7.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 1.27 111.047 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.669 HG11 ' CH2' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -101.02 109.83 26.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.531 -0.759 . . . . 1.81 109.233 179.497 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.4 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 24.4 p30 -89.69 174.13 7.91 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.399 -0.521 . . . . 0.96 110.152 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -55.36 -49.54 72.01 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.46 0.541 . . . . 1.51 112.46 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.92 -52.98 63.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.316 -0.402 . . . . 1.84 111.863 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.4 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 45.3 mt-10 -61.57 -37.14 82.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.74 110.624 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -56.55 -54.83 41.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 1.04 110.797 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.7 t -70.23 -41.36 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.798 -0.637 . . . . 1.36 111.423 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -58.34 -52.29 66.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 2.28 112.156 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.511 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -66.38 -44.2 83.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.268 -0.424 . . . . 1.21 112.028 -178.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.409 ' HE3' ' O ' ' B' ' 292' ' ' TRP . 36.4 mtt -69.1 -45.16 70.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.829 0.347 . . . . 1.48 111.702 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 63.14 2.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.026 0.441 . . . . 1.73 110.214 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -94.99 157.16 16.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.91 -0.586 . . . . 1.64 111.326 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.301 -0.857 . . . . 3.71 109.169 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.363 -0.606 . . . . 2.52 109.363 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.604 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -116.55 0.72 12.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.859 -0.61 . . . . 1.96 111.829 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -39.39 -29.88 0.06 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.645 0.98 . . . . 1.33 113.645 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.48 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 9.0 p-10 -83.66 -21.69 32.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 117.607 0.185 . . . . 1.17 111.305 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.796 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 2.1 mp -71.5 -40.02 70.43 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-O 118.999 -0.524 . . . . 2.08 111.343 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.754 ' CH2' HD11 ' A' ' 105' ' ' LEU . 64.1 m95 -56.4 -51.68 79.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 119.235 -0.986 . . . . 0.51 108.8 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.607 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 51.2 Cg_exo -60.15 -19.71 58.07 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.59 1.527 . . . . 0.76 112.354 176.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.522 ' O ' HG12 ' B' ' 298' ' ' ILE . 49.6 m -57.08 -63.66 3.41 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.802 -0.618 . . . . 0.79 110.29 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.796 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 11.2 Cg_endo -58.78 -29.61 90.29 Favored 'Trans proline' 0 C--N 1.369 1.61 0 CA-C-N 120.915 1.363 . . . . 0.85 110.94 176.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 8.3 tp -64.57 -39.01 92.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.098 -0.705 . . . . 1.42 109.098 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 38.4 ttm -70.63 -32.81 70.27 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.655 -0.869 . . . . 1.82 108.655 178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.522 HG12 ' O ' ' B' ' 294' ' ' SER . 49.0 mm -65.42 -29.88 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 108.502 -0.925 . . . . 0.84 108.502 177.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -39.36 82.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.515 -0.921 . . . . 1.89 108.515 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -64.66 -39.81 94.33 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.58 -0.896 . . . . 2.86 108.58 177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 8.8 m -69.19 -36.35 77.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.14 -0.936 . . . . 1.02 109.468 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -64.53 -37.08 86.3 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.24 -0.652 . . . . 2.62 109.24 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -62.18 -43.61 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.833 -0.621 . . . . 2.21 109.356 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -68.12 -43.32 78.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.592 -0.731 . . . . 2.06 109.454 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.626 . . . . 2.05 109.988 179.509 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.671 'CA ' ' OD1' ' A' ' 95' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.647 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.628 0.251 . . . . 2.82 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.54 -40.84 79.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 2.61 110.909 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.62 -35.89 77.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 1.78 110.452 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 5.1 mt -71.98 -40.96 68.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.144 -0.48 . . . . 1.72 110.71 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HG3' ' OH ' ' A' ' 138' ' ' TYR . 42.9 ttt-85 -65.71 -47.74 74.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.304 -0.407 . . . . 2.53 110.449 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.404 ' O ' HG23 ' A' ' 91' ' ' VAL . 21.7 mm-40 -68.43 -26.85 65.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 1.91 110.814 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.05 -38.62 89.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.25 -0.432 . . . . 1.14 110.114 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -59.62 -39.36 84.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 1.11 109.945 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -67.34 -38.88 85.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.894 -0.594 . . . . 2.28 110.185 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 87' ' ' GLU . 61.4 t -70.9 -35.58 60.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 1.36 110.484 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -69.13 -49.96 52.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.943 -0.571 . . . . 1.31 109.958 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.662 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 22.3 t0 -81.6 74.48 8.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.95 109.741 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -66.97 -28.81 68.57 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.65 111.763 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.621 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.0 OUTLIER -74.8 -31.32 61.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.825 0.345 . . . . 1.36 110.471 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.53 60.55 2.62 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.895 -0.669 . . . . 1.08 113.23 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.426 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 7.6 p-10 -122.99 -7.02 8.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.95 110.097 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.11 10.53 68.76 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.742 -0.663 . . . . 0.71 112.965 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -142.51 129.59 20.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.883 0.373 . . . . 1.44 111.221 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.512 ' HB ' HG21 ' A' ' 136' ' ' VAL . 54.9 mt -79.68 103.04 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.941 -0.763 . . . . 1.18 108.941 178.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 43.9 t -82.0 160.62 23.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.829 -0.623 . . . . 1.48 110.255 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.491 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.01 -39.09 80.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 0.86 110.304 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.37 -35.58 81.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 1.01 110.558 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.35 -36.96 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.976 -0.556 . . . . 0.88 110.055 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.736 HD11 ' CZ3' ' B' ' 292' ' ' TRP . 12.4 tp -66.94 -34.5 77.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.254 0.549 . . . . 0.97 109.562 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 16.1 mtm180 -70.22 -15.69 62.96 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.879 -0.6 . . . . 2.51 110.198 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.92 4.3 52.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.321 0.581 . . . . 1.44 110.13 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.2 t -114.14 -49.44 5.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.41 -0.814 . . . . 1.04 109.276 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -8.42 51.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.883 . . . . 1.88 111.826 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.445 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -72.53 -41.55 65.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.366 0.603 . . . . 2.02 109.63 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -78.12 -14.56 59.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.415 -0.812 . . . . 2.2 109.919 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.4 tt -63.54 -32.62 74.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 1.67 110.135 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.57 -62.57 0.29 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.242 -0.743 . . . . 1.25 111.242 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.53 82.31 4.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.243 0.544 . . . . 2.09 110.161 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 110' ' ' THR . 34.8 mttp -81.73 111.16 17.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.713 -0.676 . . . . 2.24 110.214 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.45 ' HB2' ' HB2' ' A' ' 120' ' ' GLU . 0.1 OUTLIER -85.33 175.25 9.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.334 -0.394 . . . . 1.64 110.816 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.469 ' O ' HG22 ' A' ' 121' ' ' VAL . 37.0 p -73.61 163.62 27.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.386 -0.37 . . . . 1.25 110.903 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -61.48 -31.41 71.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.956 0.408 . . . . 1.99 110.211 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -64.31 -40.26 95.56 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.48 0.657 . . . . 2.75 109.404 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.45 ' HB2' ' HB2' ' A' ' 116' ' ' LEU . 46.6 mt-10 -74.44 -33.19 62.87 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.328 -0.851 . . . . 1.14 110.223 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 117' ' ' THR . 81.8 t -61.43 -40.23 85.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 108.225 -1.028 . . . . 1.34 108.225 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.23 -45.0 95.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.653 -1.158 . . . . 1.38 109.531 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.61 -38.32 90.59 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.0 -0.546 . . . . 1.94 110.204 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.408 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 6.5 mtp -59.5 -48.0 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 1.08 111.136 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.442 ' HA ' ' HZ2' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -73.97 -35.27 41.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 C-N-CA 120.539 -0.465 . . . . 1.33 110.414 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 126' ' ' ARG . 28.5 mtm180 -64.62 -34.05 77.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.051 0.453 . . . . 1.97 110.018 178.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -73.45 -17.78 61.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.485 0.66 . . . . 1.55 109.417 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -108.17 8.69 28.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.378 -0.828 . . . . 0.82 110.21 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.646 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 27.3 t0 -117.17 116.03 26.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.049 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.53 -29.45 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.155 -0.475 . . . . 1.45 110.734 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.617 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -77.22 -15.24 59.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 1.35 110.64 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.45 60.66 4.58 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.239 -0.505 . . . . 1.25 112.819 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.529 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.6 OUTLIER -123.66 -17.08 6.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.586 0.231 . . . . 1.13 111.468 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.05 -3.79 55.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.371 -0.918 . . . . 0.99 113.065 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -136.41 161.45 35.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.696 -0.483 . . . . 1.27 109.696 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.578 HG11 ' CH2' ' B' ' 292' ' ' TRP . 3.2 m -106.81 115.46 48.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 108.865 -0.791 . . . . 1.81 108.865 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.589 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.2 p30 -88.54 -176.22 5.22 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.851 -0.425 . . . . 0.96 109.851 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.408 ' OH ' ' HG3' ' A' ' 86' ' ' ARG . 18.7 t80 -59.34 -45.88 90.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.755 0.312 . . . . 1.51 111.746 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.28 -42.03 99.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.279 -0.419 . . . . 1.84 111.249 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.589 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 26.4 mt-10 -73.34 -32.17 64.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.74 110.132 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.83 -56.94 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.244 -0.889 . . . . 1.04 110.851 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.55 -33.01 55.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 115.851 -0.613 . . . . 1.36 110.807 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -38.69 90.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 2.28 111.1 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -43.37 26.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.305 -0.407 . . . . 1.21 111.421 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.477 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -66.24 -49.37 67.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.255 -0.429 . . . . 1.48 111.903 -179.178 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.32 31.14 2.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.972 0.415 . . . . 1.73 111.082 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.67 121.14 10.88 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.861 -0.609 . . . . 1.64 111.448 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.497 -0.763 . . . . 3.71 109.569 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.799 0.333 . . . . 2.52 110.531 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 288' ' ' ALA . . . . . 0.408 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -63.26 -47.36 82.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 1.96 111.345 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -44.36 -45.1 8.68 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 113.363 0.875 . . . . 1.33 113.363 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 290' ' ' ASN . . . . . 0.473 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.3 p-10 -90.72 -26.99 19.25 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.55 0.574 . . . . 1.17 112.55 -179.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 291' ' ' LEU . . . . . 0.527 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -68.93 -45.12 71.61 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 120.172 -0.611 . . . . 2.08 112.624 -178.449 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 292' ' ' TRP . . . . . 0.736 ' CZ3' HD11 ' A' ' 105' ' ' LEU . 89.5 m95 -54.68 -51.5 78.17 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 118.809 0.731 . . . . 0.51 109.739 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 293' ' ' PRO . . . . . 0.553 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 36.0 Cg_exo -62.57 -18.35 63.19 Favored 'Trans proline' 0 C--N 1.363 1.321 0 C-N-CA 121.506 1.471 . . . . 0.76 112.326 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 294' ' ' SER . . . . . 0.548 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 61.6 m -58.74 -60.85 9.08 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 118.374 -0.822 . . . . 0.79 110.414 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 295' ' ' PRO . . . . . 0.651 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 35.2 Cg_exo -60.94 -29.7 88.54 Favored 'Trans proline' 0 C--N 1.373 1.829 0 CA-C-N 121.359 1.521 . . . . 0.85 110.562 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.14 -44.18 97.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.095 -0.706 . . . . 1.42 109.095 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 30.8 ttm -64.91 -35.91 82.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.373 -0.83 . . . . 1.82 109.072 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 298' ' ' ILE . . . . . 0.468 HG12 ' O ' ' B' ' 294' ' ' SER . 39.7 mm -61.72 -33.38 57.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.652 -0.703 . . . . 0.84 109.476 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -40.29 95.19 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 108.777 -0.823 . . . . 1.89 108.777 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.8 -44.69 84.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.482 -0.781 . . . . 2.86 109.34 178.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 18.2 m -64.41 -36.31 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.973 -0.558 . . . . 1.02 109.738 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -66.18 -33.38 75.62 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.901 -0.777 . . . . 2.62 108.901 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -69.26 -32.13 71.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 2.21 109.217 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -72.83 -46.09 54.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.472 -0.786 . . . . 2.06 110.009 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 116.396 -0.365 . . . . 2.05 110.029 179.37 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1000 ' ' ' CA' . . . . . 0.662 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1001 ' ' ' CA' . . . . . 0.646 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 120.712 0.291 . . . . 2.61 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -33.72 72.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 1.78 111.481 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.475 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.6 mt -68.21 -43.09 85.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.013 0.435 . . . . 1.33 110.319 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -64.91 -47.63 77.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.661 -0.7 . . . . 2.26 110.488 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -68.73 -30.01 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.916 -0.583 . . . . 1.91 110.882 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.34 82.62 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.479 -0.328 . . . . 1.0 110.676 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.5 -38.96 75.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.034 0.445 . . . . 0.86 110.329 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -70.73 -35.5 72.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.911 -0.586 . . . . 1.84 110.526 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.463 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 98.2 t -72.49 -35.18 50.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.092 -0.504 . . . . 1.24 110.76 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -73.45 -39.05 65.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 1.06 110.09 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.7 103.87 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.646 -0.706 . . . . 0.95 110.776 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 2.5 mptt -94.63 -28.66 15.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.443 -0.344 . . . . 1.28 111.563 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.423 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -77.32 -21.81 52.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.841 0.353 . . . . 1.36 111.028 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.7 57.55 4.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.032 -0.604 . . . . 1.02 113.391 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 19.8 p-10 -125.88 -1.11 7.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.046 0.451 . . . . 0.86 110.413 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.94 23.96 73.26 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.946 -0.645 . . . . 0.67 112.231 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.44 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 42.2 m-85 -142.8 139.46 30.97 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.188 0.518 . . . . 1.29 111.102 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 105' ' ' LEU . 66.7 mt -93.03 99.34 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.113 -0.949 . . . . 0.56 109.705 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.2 t -81.9 163.87 21.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.899 -0.592 . . . . 1.33 110.126 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.38 90.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.75 110.818 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -32.88 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.89 110.993 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -74.49 -41.18 61.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.436 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.66 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.9 tp -65.52 -29.91 70.61 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.392 -0.367 . . . . 0.54 110.124 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -57.0 -56.34 23.06 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.149 -0.478 . . . . 2.15 110.107 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -58.08 -35.55 71.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.864 0.364 . . . . 1.21 111.472 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.77 -56.97 10.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.3 -0.409 . . . . 0.72 111.743 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.566 ' CE ' ' HA ' ' B' ' 292' ' ' TRP . 0.8 OUTLIER -72.5 -19.73 61.48 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.114 0.783 . . . . 1.6 113.114 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.7 p -78.64 -41.79 30.52 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.122 -0.631 . . . . 1.67 110.551 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -67.33 -23.11 65.59 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.378 0.609 . . . . 1.85 109.944 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.51 -35.51 74.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.019 -0.991 . . . . 1.23 110.337 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.01 -65.38 0.56 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.667 -0.778 . . . . 1.13 112.211 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -74.9 90.19 2.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.14 0.495 . . . . 2.09 110.75 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -83.02 104.97 13.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 1.92 110.681 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 83.3 mt -91.71 175.4 6.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.11 -0.495 . . . . 1.27 110.23 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 121' ' ' VAL . 40.6 p -76.5 166.34 23.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.703 0.287 . . . . 1.08 111.368 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.46 -37.87 70.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 1.99 110.685 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.28 -44.17 95.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.048 -0.524 . . . . 2.75 110.575 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 124' ' ' MET . 37.8 mt-10 -67.9 -37.31 81.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 1.14 110.336 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.463 ' O ' ' HB2' ' A' ' 124' ' ' MET . 97.6 t -64.98 -41.45 92.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 N-CA-C 109.04 -0.726 . . . . 0.86 109.04 177.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.4 t70 -65.69 -44.26 86.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.87 -0.789 . . . . 1.38 108.87 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 127' ' ' GLU . 19.9 tt0 -53.01 -41.58 64.78 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.446 -0.797 . . . . 1.94 109.704 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.623 ' HG2' ' HB3' ' B' ' 288' ' ' ALA . 57.3 mtp -54.47 -51.0 66.41 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.07 -0.968 . . . . 0.66 110.852 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.852 HG23 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -76.49 -22.49 15.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.251 -0.58 . . . . 0.85 111.002 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 59.3 mtm-85 -65.33 -37.08 85.99 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.35 -0.611 . . . . 1.7 109.35 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' B' ' 289' ' ' ALA . 12.8 pt-20 -92.41 -1.99 56.63 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 1.55 109.988 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.599 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -107.55 5.38 26.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.511 0.672 . . . . 0.66 109.682 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.66 125.51 52.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.11 -0.95 . . . . 0.8 109.708 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.72 -27.12 2.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.186 -0.461 . . . . 1.23 110.791 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.52 -10.34 59.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.282 -0.417 . . . . 1.35 111.072 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.48 62.51 3.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.745 -0.74 . . . . 1.25 112.426 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.1 -17.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.649 0.261 . . . . 1.06 110.81 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.93 -14.92 63.97 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.901 -0.666 . . . . 0.9 113.298 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -119.26 169.21 10.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 1.18 110.632 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.852 HG13 HG23 ' A' ' 125' ' ' ILE . 27.0 m -106.09 113.7 43.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.142 0.496 . . . . 1.08 109.87 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.509 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 25.4 p30 -92.21 -177.63 4.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.349 -0.612 . . . . 0.84 109.349 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.92 -57.04 12.45 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.986 0.365 . . . . 1.45 111.986 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -57.45 -46.95 83.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 1.84 111.766 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.509 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 32.7 mt-10 -61.79 -42.92 99.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.795 0.331 . . . . 0.68 110.511 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.15 -45.39 91.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.774 -0.648 . . . . 0.85 110.114 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 70.3 t -64.29 -49.94 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.427 -0.806 . . . . 1.23 111.689 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.69 -38.6 87.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.437 0.532 . . . . 1.96 112.437 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.449 ' HE3' ' HB2' ' A' ' 128' ' ' ALA . 0.1 OUTLIER -70.4 -41.69 72.65 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.746 -0.382 . . . . 0.89 111.589 -179.09 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.513 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -74.99 -45.92 38.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.016 0.436 . . . . 1.14 111.006 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.43 77.88 1.68 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.205 -0.452 . . . . 1.53 110.749 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -91.72 126.77 36.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.123 -0.49 . . . . 1.64 110.721 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.24 -0.886 . . . . 3.35 109.784 179.775 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 109.072 -0.714 . . . . 2.21 109.072 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.623 ' HB3' ' HG2' ' A' ' 124' ' ' MET . . . -97.77 0.68 47.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.55 -0.75 . . . . 1.57 112.763 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 289' ' ' ALA . . . . . 0.532 ' HB2' ' OE1' ' A' ' 127' ' ' GLU . . . -32.23 -50.29 0.22 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.328 0.862 . . . . 1.18 113.328 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.529 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.9 p-10 -59.94 -24.29 64.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.64 0.257 . . . . 1.07 111.437 -179.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.589 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.3 tp -69.52 -25.17 63.9 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 109.332 -0.618 . . . . 1.52 109.332 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.644 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 53.5 m95 -60.88 -56.96 29.93 Favored Pre-proline 0 C--O 1.249 1.045 0 N-CA-C 106.976 -1.49 . . . . 0.48 106.976 176.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 50.2 Cg_exo -59.17 -17.85 41.08 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 121.268 1.312 . . . . 0.61 112.276 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 43.4 m -56.7 -64.73 2.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-O 118.288 -0.863 . . . . 0.67 110.923 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 31.4 Cg_exo -62.24 -26.49 77.53 Favored 'Trans proline' 0 C--N 1.372 1.79 0 CA-C-N 121.889 1.71 . . . . 0.58 110.62 176.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.8 tp -62.12 -44.42 96.67 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.583 0.706 . . . . 0.94 109.158 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 34.1 ttm -67.45 -32.88 74.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 1.48 108.923 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.52 HG12 ' O ' ' B' ' 294' ' ' SER . 40.7 mm -65.55 -32.48 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.211 -0.904 . . . . 0.7 109.191 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -45.18 94.46 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.89 -0.781 . . . . 1.21 108.89 177.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -66.68 -35.22 79.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.828 -0.624 . . . . 2.51 109.604 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 49.0 m -69.42 -36.74 76.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.81 109.736 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -66.98 -31.22 71.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 2.25 109.42 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -66.43 -42.48 87.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.691 -0.855 . . . . 1.76 108.691 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.43 -41.43 84.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.306 -0.861 . . . . 1.62 109.207 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 1.68 109.53 178.656 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 CA--C 1.527 0.092 0 N-CA-C 112.659 0.614 . . . . 2.61 112.659 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -63.14 -28.29 69.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 111.787 0.291 . . . . 1.78 111.787 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' B' ' 296' ' ' LEU . 0.9 OUTLIER -64.94 -48.0 85.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.23 0.538 . . . . 1.33 109.667 179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -70.6 -44.53 67.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.568 -0.742 . . . . 2.26 110.121 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 91' ' ' VAL . 42.1 mm-40 -61.02 -43.1 99.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.827 -0.624 . . . . 1.91 111.173 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.99 79.5 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.119 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -56.81 -41.37 77.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.627 -0.715 . . . . 0.86 110.64 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -68.13 -36.22 79.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.834 -0.621 . . . . 1.84 111.571 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.543 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 94.3 t -77.88 -35.83 21.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.821 0.343 . . . . 1.24 111.016 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -71.42 -33.14 69.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.504 -0.316 . . . . 1.06 110.813 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -82.9 90.01 6.91 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.607 -0.516 . . . . 0.95 109.607 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 4.6 mptt -91.64 -18.9 23.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 1.28 111.714 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.434 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER -79.46 -23.92 42.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.874 -0.33 . . . . 1.36 110.549 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.5 58.1 3.69 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.845 -0.693 . . . . 1.02 113.127 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.434 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 19.9 p-10 -126.67 -5.62 6.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.867 0.365 . . . . 0.86 110.295 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.96 17.15 77.67 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.847 -0.615 . . . . 0.67 112.751 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -143.89 139.11 29.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.703 0.287 . . . . 1.29 110.577 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.572 ' HB ' HG22 ' A' ' 136' ' ' VAL . 9.8 mt -84.76 103.12 11.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.541 -0.911 . . . . 0.56 108.541 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.506 ' HA ' ' HG2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -82.58 164.02 21.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.655 -0.702 . . . . 1.33 110.367 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -56.46 -44.41 80.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.75 111.044 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -41.33 96.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.045 0.45 . . . . 0.89 110.739 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 108' ' ' VAL . 47.7 mt-10 -67.49 -41.77 83.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.745 -0.662 . . . . 0.86 110.469 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.498 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 16.3 tp -67.31 -32.33 73.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.287 -0.415 . . . . 0.54 110.245 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.493 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 30.3 mtm-85 -57.97 -39.44 78.16 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.638 -0.504 . . . . 2.15 109.638 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -71.31 -33.48 69.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.519 . . . . 1.21 110.106 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 104' ' ' GLU . 96.0 t -62.15 -49.15 85.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.09 -0.505 . . . . 0.72 110.07 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.498 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.2 OUTLIER -66.26 -34.0 77.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 1.6 110.683 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.2 m -64.19 -45.72 87.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.912 0.386 . . . . 1.67 110.22 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -73.98 -24.25 59.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 1.85 110.26 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' B' ' 294' ' ' SER . 17.8 tp -63.69 -31.77 73.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.673 -0.694 . . . . 1.23 110.302 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.01 -40.17 2.61 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.786 -0.721 . . . . 1.13 112.071 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.68 98.0 5.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 2.09 110.474 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -89.14 100.52 13.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 1.92 110.337 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.84 -174.29 2.5 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.818 -0.628 . . . . 1.27 110.824 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 43.8 p -78.19 165.17 24.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 1.08 110.722 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.493 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 18.9 t70 -63.79 -37.63 88.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.326 -0.397 . . . . 1.99 110.737 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -66.0 -31.85 72.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.134 -0.484 . . . . 2.75 110.386 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -67.38 -37.95 83.95 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.157 -0.683 . . . . 1.14 109.157 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' A' ' 124' ' ' MET . 58.6 t -67.72 -36.33 75.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.638 -0.875 . . . . 0.86 108.638 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -65.87 -43.3 88.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.197 -0.91 . . . . 1.38 108.896 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -57.7 -38.84 75.89 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.802 -0.814 . . . . 1.94 108.802 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.692 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 38.8 mtp -58.18 -52.27 66.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.177 -0.92 . . . . 0.66 111.276 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.655 HD13 HG13 ' A' ' 136' ' ' VAL . 1.5 mm -68.67 -34.86 67.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 120.753 -0.379 . . . . 0.85 110.485 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -64.38 -29.65 70.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.947 0.403 . . . . 1.7 110.121 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.52 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 4.5 tt0 -86.14 -27.08 24.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.531 -0.759 . . . . 1.55 110.664 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -89.31 -26.12 21.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.061 -0.518 . . . . 0.66 112.027 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -90.59 109.71 20.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.981 0.419 . . . . 0.8 109.967 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 6.1 mt -100.68 -31.43 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.875 -0.602 . . . . 1.23 111.134 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.56 -20.16 58.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.773 0.321 . . . . 1.35 111.447 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.84 61.87 2.33 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.666 -0.778 . . . . 1.25 113.005 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -121.72 -14.11 8.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.858 0.361 . . . . 1.06 110.269 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.67 -11.41 61.11 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.076 -0.583 . . . . 0.9 112.632 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 101' ' ' SER . 16.5 mt-30 -132.29 165.35 24.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.329 0.585 . . . . 1.18 110.853 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.655 HG13 HD13 ' A' ' 125' ' ' ILE . 4.6 m -106.8 124.9 62.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.79 -0.819 . . . . 1.08 108.79 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.557 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.8 p30 -103.54 -178.46 3.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.442 -0.345 . . . . 0.84 110.348 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 142' ' ' VAL . 68.9 t80 -59.2 -44.18 92.23 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 111.914 0.339 . . . . 1.45 111.914 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -61.97 -46.08 90.85 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.698 0.285 . . . . 1.84 111.524 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.557 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 31.7 mt-10 -72.29 -32.24 66.43 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.123 0.487 . . . . 0.68 110.384 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 10.3 t80 -58.89 -52.73 64.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.351 -0.84 . . . . 0.85 111.56 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 138' ' ' TYR . 44.7 t -60.82 -36.48 71.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.488 . . . . 1.23 111.463 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.0 -25.76 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.41 . . . . 1.96 111.912 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.52 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -73.15 -56.46 5.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.075 0.464 . . . . 0.89 110.901 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.555 ' HG2' HD22 ' B' ' 296' ' ' LEU . 2.0 mpt? -68.46 -53.29 24.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.814 -0.63 . . . . 1.14 111.244 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 73.77 10.02 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.931 0.396 . . . . 1.53 110.956 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 65.98 6.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 1.64 110.908 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 41.0 mmtt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.697 -0.668 . . . . 3.35 110.287 -179.971 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.572 ' HA ' ' CZ ' ' B' ' 287' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 109.906 -0.405 . . . . 2.21 109.906 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.692 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -111.17 -28.76 8.14 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.861 0.689 . . . . 1.57 112.861 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.39 -33.95 9.99 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 1.18 112.54 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 21.5 p-10 -92.1 -30.68 15.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 111.967 0.358 . . . . 1.07 111.967 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.782 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 6.1 tp -72.79 -41.71 64.71 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 113.426 0.899 . . . . 1.52 113.426 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' A' ' 136' ' ' VAL . 77.0 m95 -56.61 -50.87 85.36 Favored Pre-proline 0 C--O 1.247 0.954 0 CA-C-N 119.918 1.236 . . . . 0.48 108.989 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 44.6 Cg_exo -60.53 -21.71 69.44 Favored 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 121.591 1.527 . . . . 0.61 111.877 176.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 66.6 m -55.84 -65.27 1.6 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-O 118.523 -0.751 . . . . 0.67 110.809 179.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.782 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 13.5 Cg_endo -60.02 -31.21 93.17 Favored 'Trans proline' 0 C--N 1.368 1.589 0 CA-C-N 121.345 1.516 . . . . 0.58 111.665 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.602 HD11 ' HA ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -64.79 -44.79 88.8 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.004 -0.678 . . . . 0.94 109.926 178.47 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 43.4 ttm -69.39 -35.37 75.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.115 -0.698 . . . . 1.48 109.115 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' B' ' 295' ' ' PRO . 22.8 mm -65.62 -30.49 50.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.333 -0.849 . . . . 0.7 109.118 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -68.08 -39.03 82.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.076 -0.713 . . . . 1.21 109.076 178.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -65.17 -36.63 84.81 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.264 -1.013 . . . . 2.51 108.264 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 10.9 m -71.55 -32.63 68.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.013 -0.994 . . . . 0.81 109.291 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -69.2 -38.62 78.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.464 -0.939 . . . . 2.25 108.464 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -60.27 -42.43 95.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.307 -0.998 . . . . 1.76 108.307 177.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -62.54 -41.22 98.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.922 -1.035 . . . . 1.62 109.086 177.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.292 -0.867 . . . . 1.68 110.263 179.405 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.082 0 CA-C-O 120.505 0.193 . . . . 2.61 111.495 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.46 -31.86 68.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.531 -0.304 . . . . 1.78 111.548 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.559 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.1 mt -66.36 -42.7 91.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.923 0.392 . . . . 1.33 110.479 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -65.1 -41.09 95.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.395 0.617 . . . . 2.26 109.433 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -68.02 -39.85 83.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.691 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.44 -41.84 77.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.024 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -57.77 -38.76 75.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.072 -0.513 . . . . 0.86 110.818 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -74.71 -40.02 61.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.183 -0.462 . . . . 1.84 111.006 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.25 -36.94 78.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 1.24 111.052 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -73.72 -40.03 63.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.41 . . . . 1.06 110.192 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.516 ' HA ' ' OE2' ' A' ' 104' ' ' GLU . 31.0 t70 -81.98 75.55 8.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.415 0.626 . . . . 0.95 110.175 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -77.74 -21.62 51.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.394 -0.821 . . . . 1.28 111.225 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -77.97 -13.05 60.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.566 -0.288 . . . . 1.36 110.786 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 63.5 63.95 4.1 Favored Glycine 0 C--N 1.333 0.363 0 CA-C-N 115.925 -0.579 . . . . 1.02 112.962 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.405 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 0.3 OUTLIER -132.57 -8.62 3.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.871 0.367 . . . . 0.86 110.528 -179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.71 15.75 74.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.14 -0.552 . . . . 0.67 113.937 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -144.76 133.62 22.45 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.422 0.611 . . . . 1.29 110.929 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.474 HG21 HD13 ' A' ' 105' ' ' LEU . 33.6 mt -81.99 112.58 20.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.839 -0.618 . . . . 0.56 109.62 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.5 p -95.67 172.97 7.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 1.33 110.166 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.88 92.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.659 0.266 . . . . 0.75 110.298 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.03 76.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.89 111.092 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.516 ' OE2' ' HA ' ' A' ' 93' ' ' ASP . 49.1 mt-10 -63.01 -36.83 84.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.987 -0.551 . . . . 0.86 111.166 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.571 HD22 ' CD1' ' A' ' 125' ' ' ILE . 7.0 tp -76.73 -34.54 58.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.643 -0.253 . . . . 0.54 111.02 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.413 ' NE ' HG11 ' A' ' 121' ' ' VAL . 36.1 mtt180 -58.81 -37.31 76.12 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.705 -0.48 . . . . 2.15 109.705 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.0 -23.05 65.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.493 -0.776 . . . . 1.21 110.62 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.6 t -83.04 -47.35 18.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.929 -0.578 . . . . 0.72 110.564 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.6 mmt -66.27 -30.42 70.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.81 -0.632 . . . . 1.6 112.091 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -41.5 86.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.043 0.449 . . . . 1.67 110.247 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.77 -27.76 62.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.763 -0.653 . . . . 1.85 109.555 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.4 tp -63.3 -39.49 94.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.309 -0.859 . . . . 1.23 109.703 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.88 -31.16 4.85 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.63 -0.714 . . . . 1.13 111.608 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.0 93.07 7.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.373 0.606 . . . . 2.09 110.695 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -87.86 95.83 10.25 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.516 -0.766 . . . . 1.92 109.336 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.92 163.57 17.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.964 -0.562 . . . . 1.27 111.148 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.7 p -81.24 169.35 17.43 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.836 -0.62 . . . . 1.08 110.05 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -36.03 70.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.875 0.369 . . . . 1.99 110.969 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.0 -46.72 76.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 2.75 110.421 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.03 -37.36 83.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.891 -0.595 . . . . 1.14 110.636 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 117' ' ' THR . 69.6 t -63.23 -32.25 55.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.954 0.407 . . . . 0.86 110.0 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.5 -53.0 61.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.028 -0.533 . . . . 1.38 109.784 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 126' ' ' ARG . 19.6 tt0 -67.75 -26.79 66.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.091 -0.504 . . . . 1.94 110.059 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.758 ' HE3' ' HB3' ' B' ' 291' ' ' LEU . 0.0 OUTLIER -52.87 -53.76 44.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.746 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.571 ' CD1' HD22 ' A' ' 105' ' ' LEU . 1.1 mt -89.36 -18.98 7.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.363 -0.535 . . . . 0.85 110.586 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 123' ' ' GLU . 14.2 ttm180 -65.16 -35.47 81.2 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 108.916 -0.772 . . . . 1.7 108.916 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.422 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 7.0 tt0 -74.42 -16.32 60.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.952 -1.022 . . . . 1.55 109.19 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.63 31.81 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.19 -0.913 . . . . 0.66 110.594 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -112.36 112.95 24.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.401 0.619 . . . . 0.8 110.331 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mt -106.11 -36.78 3.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.358 -0.837 . . . . 1.23 110.817 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.42 -29.99 64.22 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.749 0.277 . . . . 1.35 111.749 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 93.46 21.95 27.98 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.543 -0.837 . . . . 1.25 112.367 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.577 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 1.6 p-10 -89.11 -9.32 51.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.903 0.383 . . . . 1.06 110.716 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.69 -2.74 85.29 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.955 -0.64 . . . . 0.9 112.944 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.577 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 12.6 mt-30 -120.38 169.76 10.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.959 0.409 . . . . 1.18 110.284 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.662 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -116.12 105.29 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.466 -0.788 . . . . 1.08 109.309 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.578 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.6 p30 -95.73 175.71 6.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.808 -0.633 . . . . 0.84 109.958 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.443 ' O ' HG23 ' A' ' 142' ' ' VAL . 50.2 t80 -51.61 -45.33 63.17 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.467 0.479 . . . . 1.45 111.624 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.79 -50.4 74.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.707 -0.679 . . . . 1.84 112.028 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.578 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 23.6 mt-10 -72.74 -32.8 65.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.076 0.465 . . . . 0.68 111.197 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.8 -53.17 59.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.85 112.085 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 138' ' ' TYR . 61.9 t -61.23 -40.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 111.961 0.356 . . . . 1.23 111.961 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -67.47 -28.44 67.86 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.197 -0.201 . . . . 1.96 111.485 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.422 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -64.2 -48.94 73.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.142 0.496 . . . . 0.89 110.907 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.728 ' HG2' HD22 ' B' ' 296' ' ' LEU . 1.9 mpt? -77.27 -36.42 54.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.952 -0.567 . . . . 1.14 111.25 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.7 55.92 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.235 0.541 . . . . 1.53 110.554 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.18 127.89 32.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.478 -0.783 . . . . 1.64 110.605 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.945 -0.57 . . . . 3.35 110.128 179.743 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 110.197 -0.297 . . . . 2.21 110.197 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.503 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -90.23 -30.56 17.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.905 0.383 . . . . 1.57 110.532 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -49.21 -39.0 28.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.202 -0.908 . . . . 1.18 112.686 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.443 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.0 p-10 -88.5 -22.96 23.36 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.013 0.375 . . . . 1.07 112.013 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.758 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 6.9 tp -73.57 -43.27 60.23 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 118.739 -0.648 . . . . 1.52 111.878 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.662 ' CH2' HG21 ' A' ' 136' ' ' VAL . 66.6 m95 -52.96 -52.47 64.89 Favored Pre-proline 0 CA--C 1.552 1.044 0 CA-C-N 119.262 0.937 . . . . 0.48 109.663 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 41.4 Cg_exo -60.33 -23.16 73.65 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.861 1.708 . . . . 0.61 112.028 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 50.9 m -55.93 -64.79 1.93 Allowed Pre-proline 0 CA--C 1.546 0.821 0 CA-C-O 118.355 -0.831 . . . . 0.67 110.834 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 51.5 Cg_exo -57.85 -31.74 93.22 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 121.572 1.597 . . . . 0.58 111.561 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.728 HD22 ' HG2' ' A' ' 145' ' ' MET . 2.6 tp -61.15 -46.16 91.69 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.195 0.522 . . . . 0.94 109.681 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 51.0 ttm -66.99 -39.1 87.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.799 -0.637 . . . . 1.48 109.47 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.523 HG12 ' O ' ' B' ' 294' ' ' SER . 30.7 mm -61.73 -32.43 53.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.734 . . . . 0.7 109.944 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -66.85 -45.97 76.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.06 -0.518 . . . . 1.21 110.246 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.82 -34.22 77.66 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.458 -0.571 . . . . 2.51 109.458 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 15.3 m -70.73 -34.78 72.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.573 -0.739 . . . . 0.81 109.197 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -69.98 -34.89 73.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.183 -0.673 . . . . 2.25 109.183 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -63.33 -40.08 96.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.388 -0.968 . . . . 1.76 108.388 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -69.13 -38.18 78.7 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.815 -1.084 . . . . 1.62 109.417 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-N 115.649 -0.705 . . . . 1.68 109.471 178.275 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 111.555 0.205 . . . . 2.61 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.54 -44.57 89.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.769 0.318 . . . . 1.78 111.116 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.413 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -62.74 -45.91 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 1.33 110.821 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -63.52 -43.91 95.79 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 2.26 110.047 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.444 ' O ' HG23 ' A' ' 91' ' ' VAL . 19.9 mm-40 -64.09 -42.35 96.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 1.91 110.841 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.95 81.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.306 -0.407 . . . . 1.0 110.146 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -59.85 -38.58 82.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.949 -0.569 . . . . 0.86 110.168 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -65.46 -37.26 86.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 1.84 110.911 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.3 t -75.96 -35.54 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.089 0.471 . . . . 1.24 110.706 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -71.42 -36.93 71.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 1.06 110.54 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.551 ' HA ' ' OE1' ' A' ' 104' ' ' GLU . 28.7 t70 -81.06 84.46 6.5 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.765 -0.457 . . . . 0.95 109.765 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -85.89 -22.8 27.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.563 -0.744 . . . . 1.28 112.142 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.32 -11.0 58.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.977 0.418 . . . . 1.36 110.97 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.65 48.04 71.32 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.887 -0.597 . . . . 1.02 113.692 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -115.13 -6.1 12.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.99 0.395 . . . . 0.86 110.536 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 79.54 14.13 81.67 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.944 -0.646 . . . . 0.67 112.722 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -139.16 149.54 44.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.703 0.287 . . . . 1.29 110.747 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.467 ' HB ' HG12 ' A' ' 136' ' ' VAL . 6.0 mt -94.4 103.16 14.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.956 -0.757 . . . . 0.56 108.956 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -83.56 162.47 20.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.579 -0.737 . . . . 1.33 109.442 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.51 -36.13 73.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.004 0.43 . . . . 0.75 110.399 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.92 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.89 110.555 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' A' ' 93' ' ' ASP . 45.0 mt-10 -67.64 -40.37 84.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 0.86 110.825 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 5.0 tp -75.12 -26.03 58.89 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.11 0.481 . . . . 0.54 110.258 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -68.09 -13.86 62.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.238 -0.653 . . . . 2.15 109.238 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -106.33 15.78 25.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.083 -0.962 . . . . 1.21 109.024 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 104' ' ' GLU . 74.7 t -120.04 -54.92 3.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.445 -0.798 . . . . 0.72 109.622 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.571 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -69.0 -12.39 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.381 -0.827 . . . . 1.6 111.301 -179.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -37.34 68.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.159 -0.682 . . . . 1.67 109.159 178.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -79.03 -16.74 56.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.953 -1.021 . . . . 1.85 109.115 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 109' ' ' MET . 45.5 tp -67.04 -17.24 64.81 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.06 -0.973 . . . . 1.23 109.825 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 104.29 -70.52 0.26 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.667 -0.697 . . . . 1.13 112.128 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -61.78 106.33 0.67 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.989 0.423 . . . . 2.09 111.158 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -100.29 91.45 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.023 -0.535 . . . . 1.92 109.795 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.2 mt -77.33 178.84 6.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.281 -0.872 . . . . 1.27 111.105 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -77.8 172.28 13.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.349 . . . . 1.08 111.699 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -56.09 -48.57 75.88 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.093 -0.503 . . . . 1.99 111.802 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -64.49 -35.06 79.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 2.75 111.055 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.81 -39.61 79.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.884 0.373 . . . . 1.14 110.081 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.8 t -68.65 -36.89 76.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.975 -0.75 . . . . 0.86 108.975 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 4.0 t70 -63.21 -47.71 81.37 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.454 -0.943 . . . . 1.38 108.454 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.592 ' HG2' ' NH2' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -56.49 -37.3 70.2 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.388 -0.824 . . . . 1.94 109.948 178.55 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.605 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 2.5 mtp -55.43 -50.26 70.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.278 -0.874 . . . . 0.66 111.29 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.578 HG23 HG23 ' A' ' 136' ' ' VAL . 0.9 OUTLIER -79.49 -27.01 12.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.124 -0.63 . . . . 0.85 110.946 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.592 ' NH2' ' HG2' ' A' ' 123' ' ' GLU . 80.1 mtm-85 -63.84 -31.35 72.5 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 108.273 -1.01 . . . . 1.7 108.273 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -72.78 -29.38 63.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 114.861 -1.063 . . . . 1.55 109.459 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.42 -0.24 54.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.415 -0.812 . . . . 0.66 111.528 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -106.9 116.41 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.265 0.555 . . . . 0.8 110.5 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.4 mt -109.51 -32.15 2.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.779 -0.646 . . . . 1.23 110.725 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -77.79 -14.93 59.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.883 0.373 . . . . 1.35 110.826 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.2 30.87 64.48 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.039 -0.601 . . . . 1.25 112.259 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.429 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -89.67 -10.83 44.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.014 0.435 . . . . 1.06 110.378 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 -12.57 68.72 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.141 -0.552 . . . . 0.9 112.753 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.429 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 6.1 mt-30 -120.67 173.08 7.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 1.18 110.929 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.635 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -115.86 105.92 19.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.673 -0.694 . . . . 1.08 109.752 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.539 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 2.2 p30 -90.3 173.09 8.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.363 -0.381 . . . . 0.84 110.039 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -52.37 -44.89 65.51 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.308 0.38 . . . . 1.45 111.623 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -57.2 -55.11 38.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 1.84 111.199 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.539 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 33.8 mt-10 -64.72 -42.75 95.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.327 -0.397 . . . . 0.68 110.565 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -53.51 -58.0 8.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.647 -0.706 . . . . 0.85 111.436 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 65.1 t -65.81 -51.95 55.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.069 -0.514 . . . . 1.23 111.953 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -56.65 -42.82 79.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.724 0.638 . . . . 1.96 112.724 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -41.3 96.71 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.945 0.35 . . . . 0.89 111.945 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.504 ' SD ' HD22 ' B' ' 296' ' ' LEU . 10.1 mtt -81.25 -31.02 33.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.412 -0.358 . . . . 1.14 111.351 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.2 m -87.98 59.9 5.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.429 0.633 . . . . 1.53 110.596 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 137.14 36.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.448 -0.796 . . . . 1.64 110.237 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.094 -0.955 . . . . 3.35 109.974 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 109.92 -0.4 . . . . 2.21 109.92 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -116.9 -15.01 10.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.15 -0.477 . . . . 1.57 110.8 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -59.46 -18.84 43.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.399 -0.819 . . . . 1.18 112.594 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.422 ' ND2' HD12 ' B' ' 291' ' ' LEU . 13.7 p-10 -91.11 -32.03 16.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 120.822 0.344 . . . . 1.07 111.527 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.477 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.8 mp -70.09 -42.58 72.54 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 118.937 -0.554 . . . . 1.52 111.441 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' A' ' 136' ' ' VAL . 65.5 m95 -53.48 -54.63 43.47 Favored Pre-proline 0 CA--C 1.555 1.165 0 CA-C-N 118.915 0.779 . . . . 0.48 110.387 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 43.6 Cg_exo -60.75 -20.11 64.32 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.822 1.681 . . . . 0.61 112.229 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 73.9 m -58.5 -64.2 3.13 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.987 -1.006 . . . . 0.67 110.116 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 75.9 Cg_exo -54.57 -31.77 71.44 Favored 'Trans proline' 0 C--N 1.372 1.801 0 CA-C-N 121.978 1.742 . . . . 0.58 111.374 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.504 HD22 ' SD ' ' A' ' 145' ' ' MET . 6.0 tp -61.62 -48.11 82.36 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.592 0.711 . . . . 0.94 109.5 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 32.9 ttm -67.73 -30.21 69.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.625 -0.716 . . . . 1.48 109.232 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.564 HG12 ' O ' ' B' ' 294' ' ' SER . 40.2 mm -68.36 -28.72 41.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 108.886 -0.783 . . . . 0.7 108.886 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -39.95 92.0 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.992 -1.114 . . . . 1.21 107.992 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -66.2 -40.22 90.24 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.454 -0.794 . . . . 2.51 109.093 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 7.2 m -68.39 -36.22 78.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.407 -0.815 . . . . 0.81 109.551 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -69.47 -34.7 74.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.497 -0.774 . . . . 2.25 109.36 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -33.49 75.44 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.572 -0.899 . . . . 1.76 108.572 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -72.38 -46.56 54.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.301 -0.863 . . . . 1.62 109.498 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 N--CA 1.456 -0.145 0 CA-C-N 116.071 -0.513 . . . . 1.68 109.914 179.056 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--O 1.231 0.082 0 N-CA-C 111.619 0.229 . . . . 2.61 111.619 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.28 -43.07 92.56 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.771 0.286 . . . . 1.78 111.771 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 mt -66.2 -43.63 91.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.832 0.348 . . . . 1.33 110.796 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 86' ' ' ARG . 38.5 ttt-85 -62.62 -42.26 99.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.003 -0.544 . . . . 2.26 110.642 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 91' ' ' VAL . 70.9 tt0 -75.23 -33.09 61.3 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 1.91 111.167 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.61 -45.35 81.51 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.824 0.345 . . . . 1.0 110.427 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -60.56 -39.13 86.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.883 -0.599 . . . . 0.86 110.436 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.435 ' NH2' ' HA2' ' A' ' 96' ' ' GLY . 6.8 tpm_? -67.63 -31.32 71.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 1.84 110.771 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.1 t -78.53 -42.96 26.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 1.24 111.239 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.08 -40.76 82.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 1.06 110.91 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.78 76.93 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.044 -0.724 . . . . 0.95 109.044 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -71.07 -28.54 64.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.225 -0.898 . . . . 1.28 111.441 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.448 ' OD1' ' HB3' ' A' ' 97' ' ' ASN . 0.0 OUTLIER -70.11 -24.17 63.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.78 -0.368 . . . . 1.36 110.473 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.435 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 71.3 58.42 5.54 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.063 -0.589 . . . . 1.02 113.856 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.448 ' HB3' ' OD1' ' A' ' 95' ' ' ASP . 14.9 p-10 -128.72 -8.12 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.234 0.54 . . . . 0.86 110.677 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.46 65.65 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.553 -0.832 . . . . 0.67 112.151 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.583 ' CE1' ' HB3' ' A' ' 137' ' ' ASN . 40.2 m-85 -140.38 124.87 17.89 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.586 0.232 . . . . 1.29 110.611 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 HD13 ' A' ' 105' ' ' LEU . 8.0 mt -79.03 102.79 5.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.917 -0.772 . . . . 0.56 108.917 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.3 m -77.55 161.95 27.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.51 -0.768 . . . . 1.33 110.408 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.95 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.422 . . . . 0.75 110.522 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.81 71.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 0.89 111.132 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -75.99 -41.56 50.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 0.86 110.388 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.592 HD13 HG21 ' A' ' 100' ' ' ILE . 5.5 tp -74.63 -31.64 62.05 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.199 -0.455 . . . . 0.54 111.191 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.465 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 50.3 mtm-85 -57.16 -35.62 69.77 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.224 0.535 . . . . 2.15 110.041 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -69.53 -36.92 76.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.766 -0.652 . . . . 1.21 109.319 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.0 t -66.31 -41.15 88.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.427 -0.806 . . . . 0.72 109.792 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -27.12 69.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.062 0.458 . . . . 1.6 110.604 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 21.7 m -71.49 -35.11 70.68 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.317 0.579 . . . . 1.67 109.565 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -88.09 -3.04 58.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.659 -0.701 . . . . 1.85 109.856 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.8 tp -85.79 -0.49 55.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.296 -0.866 . . . . 1.23 110.13 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.31 -62.81 4.43 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.714 -0.675 . . . . 1.13 111.724 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -74.64 96.13 2.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.987 0.423 . . . . 2.09 110.615 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -81.02 99.35 8.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 1.92 109.917 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.7 mt -90.53 167.1 12.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.606 -0.725 . . . . 1.27 110.668 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.4 p -73.06 166.19 23.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.347 -0.388 . . . . 1.08 110.909 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.465 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 27.9 t0 -57.91 -43.06 85.94 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.511 0.189 . . . . 1.99 111.511 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -62.45 -35.32 78.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.667 0.27 . . . . 2.75 110.546 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -69.36 -38.64 78.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.779 -0.452 . . . . 1.14 109.779 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 117' ' ' THR . 55.5 t -68.26 -36.88 76.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.907 -0.775 . . . . 0.86 108.907 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -64.02 -42.65 97.06 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.897 -0.779 . . . . 1.38 108.897 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.53 -34.51 77.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.252 -0.885 . . . . 1.94 109.186 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.754 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 4.8 mtp -61.21 -50.1 74.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.66 110.683 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.755 HG23 HG13 ' A' ' 136' ' ' VAL . 0.7 OUTLIER -75.43 -24.38 17.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.771 -0.372 . . . . 0.85 110.388 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -66.78 -29.46 69.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.657 -0.868 . . . . 1.7 108.657 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -82.76 -20.7 35.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.826 -1.079 . . . . 1.55 109.558 178.513 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -99.91 -2.36 34.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.666 -0.697 . . . . 0.66 111.363 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -106.47 112.15 25.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.147 -0.479 . . . . 0.8 109.794 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mt -107.68 -22.47 4.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.229 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -85.39 -13.43 49.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.808 0.337 . . . . 1.35 111.677 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.01 45.08 12.22 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.94 -0.648 . . . . 1.25 113.559 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.45 -13.52 13.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.008 0.433 . . . . 1.06 110.301 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.47 -36.92 3.96 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.801 -0.714 . . . . 0.9 112.745 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -107.67 172.3 6.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.066 0.46 . . . . 1.18 110.894 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.755 HG13 HG23 ' A' ' 125' ' ' ILE . 17.0 m -107.73 118.59 55.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.206 -0.664 . . . . 1.08 109.206 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.583 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.1 p30 -92.83 177.2 6.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.669 -0.493 . . . . 0.84 109.669 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -50.19 -49.1 53.58 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 123.192 0.308 . . . . 1.45 111.783 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.91 -54.98 41.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 1.84 111.257 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.0 -42.73 98.98 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.391 -0.368 . . . . 0.68 111.007 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -53.54 -55.28 26.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.69 -0.686 . . . . 0.85 111.121 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 56.2 t -69.98 -41.1 79.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.979 -0.555 . . . . 1.23 111.892 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.76 -43.99 87.2 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.517 0.562 . . . . 1.96 112.517 -178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.4 tmt? -67.28 -45.24 77.2 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.862 0.319 . . . . 0.89 111.862 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.434 ' SD ' HD13 ' B' ' 296' ' ' LEU . 29.5 mtt -72.85 -50.89 21.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.235 -0.438 . . . . 1.14 111.844 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -90.01 50.47 1.88 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.46 0.648 . . . . 1.53 111.158 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.02 66.06 4.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.75 -0.659 . . . . 1.64 110.301 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.251 -0.881 . . . . 3.35 109.747 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.022 -0.362 . . . . 2.21 110.022 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.754 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -46.33 -40.51 11.92 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.604 0.565 . . . . 1.57 112.215 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -47.6 -45.4 27.46 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.837 0.711 . . . . 1.18 112.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -91.56 -22.71 20.2 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 112.307 0.484 . . . . 1.07 112.307 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.471 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 0.1 OUTLIER -68.76 -55.5 11.08 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 118.668 -0.682 . . . . 1.52 112.067 -178.539 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.605 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 84.0 m95 -49.1 -52.48 47.39 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 118.867 0.758 . . . . 0.48 110.869 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 57.6 Cg_exo -56.69 -28.47 75.66 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 122.035 1.823 . . . . 0.61 112.901 178.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 38.1 m -56.35 -62.72 4.35 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-O 118.358 -0.83 . . . . 0.67 110.915 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 64.8 Cg_exo -55.14 -31.63 76.39 Favored 'Trans proline' 0 C--N 1.369 1.645 0 CA-C-N 121.297 1.499 . . . . 0.58 111.677 176.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.434 HD13 ' SD ' ' A' ' 145' ' ' MET . 10.4 tp -64.82 -42.88 94.62 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.546 0.689 . . . . 0.94 109.487 178.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 46.0 ttm -66.25 -31.04 71.61 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.399 -0.963 . . . . 1.48 108.399 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 294' ' ' SER . 38.6 mm -64.85 -30.51 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 115.135 -0.939 . . . . 0.7 109.537 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -39.05 87.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.235 -1.024 . . . . 1.21 108.235 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -61.38 -43.53 98.71 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.336 -0.987 . . . . 2.51 108.336 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.6 m -67.12 -34.69 78.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.81 110.133 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 302' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 302' ' ' LYS . 25.5 tptt -68.78 -32.27 71.88 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.467 -0.568 . . . . 2.25 109.467 178.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -63.92 -36.46 84.03 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.747 -1.205 . . . . 1.76 107.747 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -66.63 -39.64 88.38 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.628 -1.169 . . . . 1.62 108.77 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-N 115.731 -0.668 . . . . 1.68 109.946 178.584 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 . . . . . 0 CA--C 1.52 -0.189 0 N-CA-C 111.639 0.237 . . . . 2.61 111.639 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.21 -43.73 83.04 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.024 0.44 . . . . 1.78 109.961 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.39 -46.2 81.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.496 -0.775 . . . . 1.33 110.983 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -63.25 -44.64 94.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.739 0.304 . . . . 2.26 110.773 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 91' ' ' VAL . 30.7 tt0 -65.03 -40.6 95.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.092 -0.504 . . . . 1.91 110.149 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.74 -46.68 81.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.08 -42.7 86.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.628 -0.715 . . . . 0.86 110.33 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -65.34 -42.97 92.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.838 -0.619 . . . . 1.84 111.162 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.523 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 89.8 t -68.33 -34.51 66.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.177 -0.465 . . . . 1.24 110.866 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.71 -38.16 64.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.33 -0.396 . . . . 1.06 110.126 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.445 ' HA ' ' OE2' ' A' ' 104' ' ' GLU . 32.0 t70 -82.48 81.59 8.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.362 0.601 . . . . 0.95 109.88 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 8.6 mttt -81.73 -15.9 52.89 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.507 -0.769 . . . . 1.28 111.766 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -81.77 -26.74 34.19 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.603 -0.439 . . . . 1.36 110.473 -179.425 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.46 23.39 40.13 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.805 -0.712 . . . . 1.02 114.848 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.428 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 12.7 p-10 -96.92 -8.51 30.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.781 0.791 . . . . 0.86 111.127 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.05 20.8 66.8 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.772 -0.728 . . . . 0.67 112.334 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -144.62 130.67 19.43 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.888 -0.412 . . . . 1.29 109.888 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.597 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 65.7 mt -76.44 102.21 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.163 -0.68 . . . . 0.56 109.163 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -81.27 165.72 21.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.12 -0.491 . . . . 1.33 109.692 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.59 68.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.802 0.334 . . . . 0.75 111.283 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.77 -42.41 70.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.072 0.463 . . . . 0.89 110.199 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 108' ' ' VAL . 41.4 mt-10 -70.16 -37.06 75.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.556 -0.747 . . . . 0.86 110.304 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.679 HD22 HG12 ' A' ' 125' ' ' ILE . 19.2 tp -67.88 -29.39 68.48 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.329 0.585 . . . . 0.54 109.782 178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -76.91 5.11 8.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.461 -0.79 . . . . 2.15 109.926 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -125.31 16.2 8.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.303 -0.862 . . . . 1.21 109.066 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 104' ' ' GLU . 94.0 t -120.59 -66.87 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.633 -0.712 . . . . 0.72 110.535 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.478 ' HG2' ' SD ' ' A' ' 124' ' ' MET . 0.8 OUTLIER -67.77 -18.88 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.672 -0.695 . . . . 1.6 111.323 -178.788 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -45.88 51.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.653 0.74 . . . . 1.67 109.383 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.87 -25.29 65.45 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 114.972 -1.013 . . . . 1.85 109.389 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.472 HD22 ' HD3' ' B' ' 295' ' ' PRO . 11.6 tp -60.28 -25.59 65.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.865 -1.061 . . . . 1.23 110.554 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.98 -35.18 4.28 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.921 -0.657 . . . . 1.13 111.903 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -66.91 102.64 0.99 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.0 0.429 . . . . 2.09 111.001 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -85.2 85.51 7.46 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.897 -0.592 . . . . 1.92 109.901 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.425 HD11 HD22 ' B' ' 291' ' ' LEU . 73.0 mt -95.57 162.61 13.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.577 -0.738 . . . . 1.27 111.45 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 22.3 p -87.14 170.56 11.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.352 -0.84 . . . . 1.08 110.524 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -55.94 -42.7 76.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 1.99 110.921 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.55 -39.89 92.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.288 -0.415 . . . . 2.75 110.753 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.87 -37.23 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 1.14 110.248 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 124' ' ' MET . 56.1 t -67.19 -36.24 76.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.8 -0.815 . . . . 0.86 108.8 177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 23.5 t70 -63.59 -43.12 97.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.34 -0.846 . . . . 1.38 109.395 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.11 -34.69 78.16 Favored 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 109.406 -0.59 . . . . 1.94 109.406 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.689 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 5.6 mtp -60.07 -50.77 72.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.565 -0.743 . . . . 0.66 110.499 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.967 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -75.45 -22.81 16.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.664 -0.414 . . . . 0.85 110.197 179.432 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 10.2 ttm180 -67.05 -23.6 65.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.289 -0.634 . . . . 1.7 109.289 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -92.55 -19.39 22.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.036 -0.984 . . . . 1.55 110.729 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -97.44 -41.22 8.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.893 0.331 . . . . 0.66 111.893 -179.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.433 ' HB2' HD12 ' A' ' 125' ' ' ILE . 19.6 t0 -79.87 106.99 12.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.22 0.534 . . . . 0.8 110.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -99.64 -34.09 4.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.565 -0.743 . . . . 1.23 110.972 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -74.55 -23.59 58.81 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.631 0.253 . . . . 1.35 111.242 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.04 29.4 34.31 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.77 -0.729 . . . . 1.25 112.743 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -84.92 -20.3 30.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.901 0.381 . . . . 1.06 110.32 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.03 -7.9 59.04 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 121.031 -0.604 . . . . 0.9 112.943 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -128.26 163.71 24.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.392 0.615 . . . . 1.18 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.967 HG22 HD11 ' A' ' 125' ' ' ILE . 0.1 OUTLIER -99.73 101.15 11.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.188 -0.915 . . . . 1.08 108.826 178.745 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -86.34 171.61 11.06 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.768 -0.373 . . . . 0.84 110.579 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -51.71 -50.41 60.57 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.498 0.499 . . . . 1.45 111.957 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.67 -55.03 39.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.604 -0.271 . . . . 1.84 111.463 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.55 -43.45 97.21 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.816 0.341 . . . . 0.68 110.547 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -55.03 -54.26 45.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.603 -0.726 . . . . 0.85 111.178 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 89.9 t -70.16 -43.89 78.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 1.23 112.045 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -63.35 -44.0 96.09 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.333 0.494 . . . . 1.96 112.333 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.75 72.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.804 0.298 . . . . 0.89 111.804 -178.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.537 ' SD ' HD13 ' B' ' 296' ' ' LEU . 34.9 mtt -71.95 -47.7 50.46 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.993 0.368 . . . . 1.14 111.993 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 47.62 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.379 0.609 . . . . 1.53 110.527 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.59 130.27 41.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.424 -0.807 . . . . 1.64 110.268 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.188 -0.911 . . . . 3.35 109.843 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.854 0.359 . . . . 2.21 110.42 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.689 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -134.84 -10.29 2.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 1.57 111.168 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -56.39 -21.94 28.18 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 115.754 -0.657 . . . . 1.18 112.092 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.435 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 12.5 p-10 -92.0 -29.45 16.6 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.038 0.447 . . . . 1.07 111.315 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.567 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -72.21 -41.24 67.14 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-O 118.552 -0.737 . . . . 1.52 112.946 -177.685 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.647 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 66.0 m95 -57.73 -50.7 86.67 Favored Pre-proline 0 C--O 1.246 0.882 0 CA-C-N 119.546 1.066 . . . . 0.48 109.179 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 52.3 Cg_exo -58.34 -21.24 51.99 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.481 1.454 . . . . 0.61 111.735 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.57 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 69.4 m -57.63 -63.47 3.75 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-O 118.08 -0.962 . . . . 0.67 110.102 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.604 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 74.3 Cg_exo -55.72 -29.95 73.59 Favored 'Trans proline' 0 C--N 1.376 2.009 0 CA-C-N 121.815 1.684 . . . . 0.58 111.361 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.537 HD13 ' SD ' ' A' ' 145' ' ' MET . 5.1 tp -65.25 -44.18 88.97 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.328 0.585 . . . . 0.94 109.763 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 69.2 mtm -68.17 -31.23 70.63 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.235 -1.024 . . . . 1.48 108.235 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.495 HG12 ' O ' ' B' ' 294' ' ' SER . 38.1 mm -66.84 -28.94 44.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 N-CA-C 108.752 -0.833 . . . . 0.7 108.752 177.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -42.41 93.06 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.565 -0.902 . . . . 1.21 108.565 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -70.53 -35.76 73.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.632 -0.713 . . . . 2.51 109.507 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 13.6 m -67.52 -44.9 77.27 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.407 -0.59 . . . . 0.81 109.407 178.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 302' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' B' ' 298' ' ' ILE . 0.1 OUTLIER -64.22 -36.24 83.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.592 -0.731 . . . . 2.25 109.237 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 23.6 tttp -58.12 -44.31 87.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.644 -0.707 . . . . 1.76 109.462 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -68.59 -44.92 73.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.808 . . . . 1.62 109.982 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 1.68 110.538 179.358 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 N--CA 1.464 0.232 0 CA-C-O 120.819 0.343 . . . . 2.61 110.846 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.2 -34.66 73.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 1.78 110.502 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.544 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -65.4 -46.73 89.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.989 -0.55 . . . . 1.33 110.829 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -59.09 -44.22 91.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.108 -0.496 . . . . 2.26 110.576 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.433 ' CD ' ' HZ1' ' B' ' 299' ' ' LYS . 1.0 OUTLIER -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.813 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.73 80.75 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.136 0.493 . . . . 1.0 109.982 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -62.02 -38.72 89.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.241 -0.89 . . . . 0.86 110.163 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -71.86 -27.8 63.12 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.79 -0.641 . . . . 1.84 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.8 t -83.13 -45.04 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.378 -0.373 . . . . 1.24 111.258 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -66.69 -32.64 74.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.3 -0.409 . . . . 1.06 110.994 -179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -83.73 91.42 7.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.91 -0.774 . . . . 0.95 108.91 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -85.27 -33.28 22.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.831 -0.622 . . . . 1.28 112.116 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.465 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -69.14 -29.27 67.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.678 -0.409 . . . . 1.36 110.293 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.86 28.28 26.62 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.011 -0.614 . . . . 1.02 114.267 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.467 HD21 ' HB2' ' A' ' 99' ' ' TYR . 20.0 p-10 -90.8 -8.22 50.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 117.729 0.764 . . . . 0.86 110.781 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.0 17.5 61.15 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.831 -0.699 . . . . 0.67 111.728 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HB2' HD21 ' A' ' 97' ' ' ASN . 98.6 m-85 -144.54 145.32 31.77 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.76 0.314 . . . . 1.29 110.346 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.606 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 38.1 mt -90.85 100.81 11.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.954 -0.566 . . . . 0.56 109.65 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -79.35 163.19 25.06 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 1.33 110.442 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.02 -43.01 81.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 0.75 110.093 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.08 91.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.871 -0.604 . . . . 0.89 110.839 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.5 mt-10 -69.46 -37.83 77.49 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.537 -0.756 . . . . 0.86 111.036 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.603 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.1 tp -72.92 -29.79 63.4 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.766 0.317 . . . . 0.54 110.4 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.475 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 31.0 mtm-85 -61.31 -32.68 72.54 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.013 0.435 . . . . 2.15 110.306 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -82.26 -6.45 59.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.495 0.664 . . . . 1.21 110.686 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 104' ' ' GLU . 85.6 t -92.54 -51.82 10.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.902 -0.59 . . . . 0.72 110.288 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.544 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -69.22 -16.91 63.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.756 -0.656 . . . . 1.6 112.151 -178.69 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.432 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 0.4 OUTLIER -72.1 -35.84 69.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.934 0.397 . . . . 1.67 109.969 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -76.54 -20.47 56.84 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.675 -0.693 . . . . 1.85 109.864 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.59 HD11 ' HB3' ' B' ' 294' ' ' SER . 59.3 tp -71.96 -10.75 60.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.219 -0.901 . . . . 1.23 110.508 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 92.62 -42.72 2.66 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.797 -0.716 . . . . 1.13 111.342 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.02 75.69 5.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 2.09 110.148 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 57.3 mttp -73.66 113.02 10.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.441 -0.8 . . . . 1.92 110.545 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.97 179.85 4.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.912 -0.586 . . . . 1.27 110.06 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.3 p -87.32 171.09 10.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.475 -0.33 . . . . 1.08 110.845 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.475 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 25.1 t0 -59.19 -42.39 90.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.327 -0.397 . . . . 1.99 111.443 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -42.4 99.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.751 0.31 . . . . 2.75 110.534 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -65.02 -37.79 88.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 1.14 110.326 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 124' ' ' MET . 61.9 t -69.47 -40.86 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.724 -0.473 . . . . 0.86 109.724 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.47 -40.03 94.93 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.502 -0.555 . . . . 1.38 109.502 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -64.78 -34.0 77.31 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 109.161 -0.681 . . . . 1.94 109.161 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.676 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 8.0 mtp -60.87 -45.92 92.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 0.66 110.006 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.827 HG23 HG13 ' A' ' 136' ' ' VAL . 0.4 OUTLIER -77.79 -19.78 13.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.593 -0.443 . . . . 0.85 109.832 179.14 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -68.99 -30.25 68.62 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.11 -1.07 . . . . 1.7 108.11 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -88.36 -11.19 46.96 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.422 -1.263 . . . . 1.55 109.206 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -109.23 1.27 20.12 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.594 -0.73 . . . . 0.66 112.11 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -115.17 129.06 56.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.633 -0.506 . . . . 0.8 109.633 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.93 -33.59 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.255 -0.43 . . . . 1.23 111.132 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.463 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 1.4 p-10 -69.96 -25.3 63.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.874 0.369 . . . . 1.35 111.11 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.49 64.84 1.32 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.467 -0.873 . . . . 1.25 111.795 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.463 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.7 OUTLIER -131.45 -18.27 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.679 0.276 . . . . 1.06 110.793 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.47 -25.86 26.74 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.577 -0.82 . . . . 0.9 113.065 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -116.44 176.1 5.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 1.18 110.216 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.827 HG13 HG23 ' A' ' 125' ' ' ILE . 30.0 m -106.82 122.01 60.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 1.08 108.692 178.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.406 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 28.7 p30 -94.57 -177.99 4.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.426 -0.352 . . . . 0.84 110.17 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -55.92 -49.25 73.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.793 0.33 . . . . 1.45 111.694 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.73 -54.09 49.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.106 -0.497 . . . . 1.84 111.632 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.406 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 41.2 mt-10 -61.76 -39.69 92.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.341 -0.39 . . . . 0.68 111.758 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 11.3 t80 -56.39 -58.62 7.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.85 111.376 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 22.6 t -65.87 -37.06 79.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.224 -0.443 . . . . 1.23 111.366 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -62.54 -44.18 96.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 1.96 111.582 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -45.14 65.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.883 0.373 . . . . 0.89 110.796 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.47 ' CG ' HD22 ' B' ' 296' ' ' LEU . 0.2 OUTLIER -62.42 -39.3 92.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.098 -0.501 . . . . 1.14 111.659 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.57 37.52 2.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.104 0.478 . . . . 1.53 110.776 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.92 81.7 8.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.151 -0.477 . . . . 1.64 111.006 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.389 -0.815 . . . . 3.35 109.538 179.489 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.75 ' N ' HD22 ' B' ' 290' ' ' ASN . 63.0 mtp180 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.821 0.343 . . . . 2.21 110.591 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.676 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.96 -41.77 97.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 1.57 111.566 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -45.77 -41.83 11.32 Favored 'General case' 0 C--O 1.223 -0.335 0 O-C-N 123.966 0.791 . . . . 1.18 113.032 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.75 HD22 ' N ' ' B' ' 287' ' ' ARG . 3.7 p30 -90.73 -27.93 18.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.876 -0.33 . . . . 1.07 111.885 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' B' ' 294' ' ' SER . 2.5 tp -73.53 -44.85 56.65 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 113.004 0.742 . . . . 1.52 113.004 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.612 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 69.1 m95 -54.26 -53.66 56.58 Favored Pre-proline 0 CA--C 1.551 1.004 0 CA-C-N 119.534 1.061 . . . . 0.48 109.526 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 42.9 Cg_exo -61.35 -20.82 69.87 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 121.637 1.558 . . . . 0.61 112.428 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 43.4 m -55.97 -64.79 1.95 Allowed Pre-proline 0 CA--C 1.544 0.73 0 CA-C-O 118.381 -0.819 . . . . 0.67 110.375 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 46.0 Cg_exo -59.24 -31.23 94.83 Favored 'Trans proline' 0 C--N 1.37 1.689 0 CA-C-N 121.494 1.569 . . . . 0.58 111.234 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.1 tp -60.5 -46.39 90.29 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.186 0.517 . . . . 0.94 109.871 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 41.6 ttm -68.33 -31.82 71.49 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.361 -0.607 . . . . 1.48 109.361 178.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.583 HG12 ' O ' ' B' ' 294' ' ' SER . 43.4 mm -62.01 -34.97 65.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.856 -0.794 . . . . 0.7 108.856 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.433 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 2.6 tttp -66.39 -40.92 89.95 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.765 -0.652 . . . . 1.21 109.85 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -61.34 -42.62 98.98 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.886 -0.783 . . . . 2.51 108.886 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 301' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' B' ' 304' ' ' ASN . 6.4 m -70.55 -30.13 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.563 -0.744 . . . . 0.81 109.858 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 5.6 tptp -67.68 -33.75 75.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.172 -0.677 . . . . 2.25 109.172 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -65.81 -37.59 86.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.205 -1.035 . . . . 1.76 108.205 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 304' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' B' ' 301' ' ' SER . 22.6 t30 -63.86 -41.15 97.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.76 -1.109 . . . . 1.62 108.792 177.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.581 -0.736 . . . . 1.68 109.602 178.202 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 112.019 0.377 . . . . 2.61 112.019 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.47 -44.58 69.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.183 0.438 . . . . 1.78 112.183 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.632 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.4 mt -65.25 -41.43 91.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.993 0.425 . . . . 1.33 111.188 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -68.79 -43.79 74.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.055 -0.52 . . . . 2.26 110.827 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 mm-40 -70.79 -35.04 72.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.86 -0.609 . . . . 1.91 112.063 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.26 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.747 0.308 . . . . 1.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -59.19 -42.06 89.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.554 . . . . 0.86 110.377 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.06 -29.79 66.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.903 -0.59 . . . . 1.84 110.536 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.466 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 57.9 t -74.71 -41.09 47.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 1.24 110.438 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -71.89 -37.25 70.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.069 -0.514 . . . . 1.06 110.791 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -83.68 104.89 14.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.658 -0.497 . . . . 0.95 109.658 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 5.2 mptt -91.43 -39.29 12.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.089 -0.505 . . . . 1.28 111.224 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -69.48 -20.61 63.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.17 -0.468 . . . . 1.36 110.807 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.79 68.81 1.54 Allowed Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.153 -0.546 . . . . 1.02 112.774 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 24.2 p-10 -137.05 -0.41 2.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.891 0.377 . . . . 0.86 110.513 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.97 22.0 72.65 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.656 -0.783 . . . . 0.67 111.73 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.506 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 57.6 m-85 -142.82 122.86 13.63 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.688 0.28 . . . . 1.29 110.773 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.734 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 60.2 mt -82.13 102.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.712 -0.847 . . . . 0.56 108.712 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.6 t -76.32 163.29 27.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.592 -0.522 . . . . 1.33 109.592 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.5 -39.05 75.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.996 0.427 . . . . 0.75 110.459 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.91 88.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.89 110.508 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.71 -32.52 72.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.819 -0.628 . . . . 0.86 110.692 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.732 HD22 HG12 ' A' ' 125' ' ' ILE . 10.4 tp -77.27 -34.93 55.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.263 -0.426 . . . . 0.54 110.11 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.449 ' HG2' HG21 ' A' ' 121' ' ' VAL . 19.0 mtm180 -60.01 -34.22 73.05 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.515 -0.55 . . . . 2.15 109.515 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.09 -28.12 68.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.44 -0.8 . . . . 1.21 109.674 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.5 -35.33 44.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.72 109.998 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -34.77 73.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.214 -0.448 . . . . 1.6 110.345 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.469 HG23 ' HE3' ' A' ' 115' ' ' LYS . 1.3 m -63.8 -36.73 84.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.903 -0.589 . . . . 1.67 110.886 179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -84.74 -27.34 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.145 0.498 . . . . 1.85 109.952 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.84 -27.98 67.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.69 -0.686 . . . . 1.23 109.979 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.03 -49.77 0.86 Allowed Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.801 -0.636 . . . . 1.13 111.685 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.48 100.16 8.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.068 0.461 . . . . 2.09 110.019 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.469 ' HE3' HG23 ' A' ' 110' ' ' THR . 62.0 mttp -82.88 82.49 8.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.737 -0.665 . . . . 1.92 109.816 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.1 mt -72.54 166.66 22.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.689 -0.687 . . . . 1.27 111.691 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.4 p -77.4 168.67 19.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 1.08 111.095 -179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.18 -37.14 74.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.12 -0.491 . . . . 1.99 111.199 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -68.36 -37.36 80.38 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.894 0.378 . . . . 2.75 110.412 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -71.68 -34.28 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.784 -0.45 . . . . 1.14 109.784 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.449 HG21 ' HG2' ' A' ' 106' ' ' ARG . 77.0 t -67.78 -36.8 77.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.409 -0.96 . . . . 0.86 108.409 177.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 12.6 t70 -63.51 -41.99 98.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.131 -0.94 . . . . 1.38 108.572 177.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -60.65 -37.01 80.1 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.811 -0.631 . . . . 1.94 109.468 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.734 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 9.3 mtp -56.72 -51.46 68.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.218 -0.901 . . . . 0.66 111.777 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.732 HG12 HD22 ' A' ' 105' ' ' LEU . 1.4 mt -85.45 -14.07 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 119.077 -1.049 . . . . 0.85 111.382 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 20.0 ttm180 -68.11 -25.26 65.22 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.824 -1.176 . . . . 1.7 107.824 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.429 ' HB3' ' HB3' ' B' ' 288' ' ' ALA . 4.7 tt0 -97.5 -5.44 35.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 113.898 -1.501 . . . . 1.55 109.605 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.48 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -101.85 -44.59 5.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.16 -0.473 . . . . 0.66 111.733 -178.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -76.59 132.38 39.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.083 0.468 . . . . 0.8 111.179 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 37.4 mt -130.29 -23.59 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.799 -0.637 . . . . 1.23 110.893 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.473 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 1.1 p-10 -77.03 -22.4 53.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.426 -0.352 . . . . 1.35 111.828 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 98.62 -0.21 58.01 Favored Glycine 0 C--O 1.236 0.28 0 C-N-CA 120.434 -0.889 . . . . 1.25 113.699 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.473 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.1 OUTLIER -70.49 -24.68 62.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.277 0.538 . . . . 1.06 110.078 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.73 -8.17 59.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.852 -0.689 . . . . 0.9 113.461 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -123.89 -179.63 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.557 0.694 . . . . 1.18 111.169 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.734 ' CG2' ' HB ' ' A' ' 100' ' ' ILE . 0.0 OUTLIER -102.89 96.61 4.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 114.644 -1.162 . . . . 1.08 109.165 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 27.7 p30 -88.71 176.01 7.27 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.48 -0.488 . . . . 0.84 109.933 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -52.85 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.627 0.603 . . . . 1.45 112.627 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 30.5 mp0 -62.59 -50.82 69.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.457 -0.338 . . . . 1.84 111.776 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 39.4 mt-10 -62.67 -41.97 99.37 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.913 0.387 . . . . 0.68 110.706 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.427 ' HE2' ' O ' ' A' ' 85' ' ' ILE . 75.4 t80 -56.03 -56.25 23.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.535 -0.757 . . . . 0.85 111.365 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.42 -38.28 81.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.083 -0.508 . . . . 1.23 111.447 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.6 -41.52 92.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 1.96 111.429 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -38.94 62.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.039 0.447 . . . . 0.89 110.913 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.601 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -67.46 -47.64 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.495 . . . . 1.14 110.901 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.64 48.68 1.02 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.226 0.536 . . . . 1.53 109.895 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.45 101.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.671 -0.695 . . . . 1.64 110.804 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.308 -0.853 . . . . 3.35 109.833 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.723 0.297 . . . . 2.21 110.23 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.734 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -114.96 -33.9 5.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.254 -0.43 . . . . 1.57 111.178 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.33 -30.37 4.84 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 123.914 0.759 . . . . 1.18 112.344 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.483 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 20.3 p-10 -92.79 -34.18 13.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.302 0.482 . . . . 1.07 112.302 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.484 ' O ' ' HD3' ' B' ' 295' ' ' PRO . 9.6 mp -68.79 -46.66 68.14 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-O 118.3 -0.857 . . . . 1.52 112.724 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.609 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 59.8 m95 -52.98 -50.9 79.33 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-N 119.738 1.153 . . . . 0.48 109.927 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -64.01 -17.48 59.95 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 121.631 1.554 . . . . 0.61 112.385 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.584 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 74.2 m -60.32 -61.52 7.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-O 118.547 -0.739 . . . . 0.67 110.289 178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.592 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -60.88 -27.47 84.85 Favored 'Trans proline' 0 C--N 1.37 1.673 0 CA-C-N 121.481 1.565 . . . . 0.58 110.19 176.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 85' ' ' ILE . 4.4 tp -59.49 -47.74 84.33 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.041 -0.725 . . . . 0.94 109.041 177.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 50.3 ttm -67.33 -32.44 73.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.753 -0.658 . . . . 1.48 109.265 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.56 HG12 ' O ' ' B' ' 294' ' ' SER . 45.2 mm -65.66 -31.46 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.63 -0.714 . . . . 0.7 109.108 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -38.0 87.68 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.977 -1.12 . . . . 1.21 107.977 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 300' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' B' ' 303' ' ' LYS . 0.4 OUTLIER -65.36 -35.94 82.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.244 -0.889 . . . . 2.51 108.733 177.341 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.4 m -69.83 -36.43 75.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.659 -0.867 . . . . 0.81 108.659 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.5 tptp -67.75 -31.34 71.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.902 -0.777 . . . . 2.25 108.902 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 303' ' ' LYS . . . . . 0.415 ' HB3' ' O ' ' B' ' 300' ' ' ARG . 17.9 tttp -63.52 -43.73 96.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.214 -0.903 . . . . 1.76 108.794 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -69.49 -37.36 77.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.374 -0.83 . . . . 1.62 109.137 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.711 -0.677 . . . . 1.68 109.403 178.06 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.106 0.479 . . . . 2.61 110.313 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -57.54 -47.66 81.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.417 -0.811 . . . . 1.78 110.516 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.0 mt -72.02 -32.43 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.99 -0.55 . . . . 1.33 110.672 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -65.3 -45.79 82.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.116 -0.493 . . . . 2.26 110.157 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 91' ' ' VAL . 3.3 tt0 -66.62 -38.21 86.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 1.91 109.818 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.39 82.08 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.002 -0.544 . . . . 1.0 110.41 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.81 -40.9 89.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.86 110.407 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -66.33 -36.62 83.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.869 -0.605 . . . . 1.84 110.737 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 87' ' ' GLU . 58.6 t -71.84 -36.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.175 -0.466 . . . . 1.24 110.472 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 108' ' ' VAL . 3.7 m-30 -66.44 -54.03 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.476 . . . . 1.06 110.052 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -83.89 96.68 8.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.95 110.014 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -90.65 -34.6 15.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.71 -0.677 . . . . 1.28 111.63 -178.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.57 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 1.1 p-10 -68.72 -25.64 64.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.839 0.352 . . . . 1.36 110.7 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.28 44.02 7.19 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.853 -0.689 . . . . 1.02 113.121 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.57 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 2.7 p30 -97.1 -7.56 32.38 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.731 -0.47 . . . . 0.86 109.731 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.2 0.7 76.71 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.848 -0.614 . . . . 0.67 113.576 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -141.09 155.33 46.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.88 0.371 . . . . 1.29 110.639 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.674 ' HB ' HG23 ' A' ' 136' ' ' VAL . 84.9 mt -83.67 100.48 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.89 -0.781 . . . . 0.56 108.89 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -72.51 155.45 40.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.432 -0.349 . . . . 1.33 110.426 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.57 -35.81 75.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.119 0.485 . . . . 0.75 110.229 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.18 -37.89 81.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.89 109.972 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.51 -30.41 61.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.664 -0.698 . . . . 0.86 110.142 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.719 HD22 HG12 ' A' ' 125' ' ' ILE . 18.8 tp -72.15 -40.64 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.859 -0.609 . . . . 0.54 109.954 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 1.042 ' HG2' HG11 ' A' ' 121' ' ' VAL . 20.3 mtm180 -57.61 -33.35 68.14 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.466 -0.334 . . . . 2.15 110.586 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.795 -0.639 . . . . 1.21 109.744 179.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 92' ' ' PHE . 16.0 t -70.43 -40.82 78.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.724 -0.671 . . . . 0.72 110.403 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.616 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -61.12 -46.95 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.939 -0.573 . . . . 1.6 111.049 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.7 p -70.57 -32.58 70.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.885 0.374 . . . . 1.67 111.157 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -71.03 -28.16 64.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.285 -0.416 . . . . 1.85 110.156 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 51.7 tp -64.69 -29.56 70.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.82 -0.627 . . . . 1.23 110.465 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 111.3 -41.72 2.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.854 -0.688 . . . . 1.13 111.701 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -74.07 100.49 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.28 0.562 . . . . 2.09 109.784 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -81.87 123.13 28.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.509 -0.768 . . . . 1.92 111.268 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.0 mt -118.45 162.56 18.14 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.727 -0.67 . . . . 1.27 109.698 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.412 ' O ' HG23 ' A' ' 121' ' ' VAL . 26.6 p -75.07 168.22 20.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.992 -0.373 . . . . 1.08 109.992 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.3 -36.5 75.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.947 0.403 . . . . 1.99 110.249 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.01 -45.03 83.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.712 -0.677 . . . . 2.75 110.155 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.75 -38.41 86.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 1.14 110.708 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 1.042 HG11 ' HG2' ' A' ' 106' ' ' ARG . 85.1 t -67.12 -40.89 86.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.481 -0.563 . . . . 0.86 109.481 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.553 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 21.3 t70 -64.5 -40.07 94.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.046 -0.724 . . . . 1.38 109.046 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.04 -35.24 74.68 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.563 -0.532 . . . . 1.94 109.563 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.61 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -55.86 -45.08 78.59 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 0.66 109.763 178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.994 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -81.05 -27.82 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.845 -0.616 . . . . 0.85 111.202 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 44.2 mtm-85 -68.92 -19.93 64.21 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.451 0.643 . . . . 1.7 109.663 178.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.17 -13.28 26.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.056 -0.975 . . . . 1.55 109.876 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.751 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -102.44 -35.82 8.64 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.736 -0.666 . . . . 0.66 111.572 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -83.47 104.87 13.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.936 0.398 . . . . 0.8 110.294 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.66 -32.4 3.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.854 -0.612 . . . . 1.23 111.303 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.42 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 0.6 OUTLIER -74.8 -12.93 60.51 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 1.35 111.375 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 69.53 61.02 4.68 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.102 -0.57 . . . . 1.25 112.538 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.42 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.9 OUTLIER -118.46 -19.85 8.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.552 0.215 . . . . 1.06 110.669 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.27 -22.46 32.86 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.669 -0.777 . . . . 0.9 112.941 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -122.81 173.29 7.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 1.18 111.047 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.994 HG22 HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -101.02 109.83 26.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.531 -0.759 . . . . 1.08 109.233 179.497 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 24.4 p30 -89.69 174.13 7.91 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.399 -0.521 . . . . 0.84 110.152 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -55.36 -49.54 72.01 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.46 0.541 . . . . 1.45 112.46 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.92 -52.98 63.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.316 -0.402 . . . . 1.84 111.863 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.402 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 45.3 mt-10 -61.57 -37.14 82.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.68 110.624 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -56.55 -54.83 41.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.85 110.797 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.7 t -70.23 -41.36 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.798 -0.637 . . . . 1.23 111.423 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -58.34 -52.29 66.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 1.96 112.156 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.431 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -66.38 -44.2 83.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.268 -0.424 . . . . 0.89 112.028 -178.122 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.453 ' HE2' ' O ' ' B' ' 292' ' ' TRP . 36.4 mtt -69.1 -45.16 70.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.829 0.347 . . . . 1.14 111.702 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 63.14 2.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.026 0.441 . . . . 1.53 110.214 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -94.99 157.16 16.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.91 -0.586 . . . . 1.64 111.326 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.301 -0.857 . . . . 3.35 109.169 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.363 -0.606 . . . . 2.21 109.363 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.61 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -116.55 0.72 12.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.859 -0.61 . . . . 1.57 111.829 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -39.39 -29.88 0.06 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.645 0.98 . . . . 1.18 113.645 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.484 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 9.0 p-10 -83.66 -21.69 32.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 117.607 0.185 . . . . 1.07 111.305 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.825 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 2.1 mp -71.5 -40.02 70.43 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-O 118.999 -0.524 . . . . 1.52 111.343 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.656 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 64.1 m95 -56.4 -51.68 79.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 119.235 -0.986 . . . . 0.48 108.8 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 51.2 Cg_exo -60.15 -19.71 58.07 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.59 1.527 . . . . 0.61 112.354 176.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.531 ' O ' HG12 ' B' ' 298' ' ' ILE . 49.6 m -57.08 -63.66 3.41 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.802 -0.618 . . . . 0.67 110.29 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.825 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 11.2 Cg_endo -58.78 -29.61 90.29 Favored 'Trans proline' 0 C--N 1.369 1.61 0 CA-C-N 120.915 1.363 . . . . 0.58 110.94 176.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.442 HD13 ' SD ' ' A' ' 145' ' ' MET . 8.3 tp -64.57 -39.01 92.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.098 -0.705 . . . . 0.94 109.098 177.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 38.4 ttm -70.63 -32.81 70.27 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.655 -0.869 . . . . 1.48 108.655 178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.531 HG12 ' O ' ' B' ' 294' ' ' SER . 49.0 mm -65.42 -29.88 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 108.502 -0.925 . . . . 0.7 108.502 177.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -39.36 82.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.515 -0.921 . . . . 1.21 108.515 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -64.66 -39.81 94.33 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.58 -0.896 . . . . 2.51 108.58 177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 8.8 m -69.19 -36.35 77.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.14 -0.936 . . . . 0.81 109.468 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -64.53 -37.08 86.3 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.24 -0.652 . . . . 2.25 109.24 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -62.18 -43.61 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.833 -0.621 . . . . 1.76 109.356 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -68.12 -43.32 78.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.592 -0.731 . . . . 1.62 109.454 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.626 . . . . 1.68 109.988 179.509 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.738 0.304 . . . . 2.61 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.413 ' OE2' ' HE2' ' B' ' 299' ' ' LYS . 0.5 OUTLIER -60.62 -35.89 77.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 1.78 110.452 179.293 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.579 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.1 mt -71.98 -40.96 68.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.71 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG3' ' OH ' ' A' ' 138' ' ' TYR . 42.9 ttt-85 -65.71 -47.74 74.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.304 -0.407 . . . . 2.26 110.449 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 91' ' ' VAL . 21.7 mm-40 -68.43 -26.85 65.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 1.91 110.814 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.05 -38.62 89.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.114 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -59.62 -39.36 84.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.86 109.945 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -67.34 -38.88 85.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.894 -0.594 . . . . 1.84 110.185 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 87' ' ' GLU . 61.4 t -70.9 -35.58 60.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 1.24 110.484 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -69.13 -49.96 52.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.943 -0.571 . . . . 1.06 109.958 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -81.6 74.48 8.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.95 109.741 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -66.97 -28.81 68.57 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.28 111.763 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.43 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.0 OUTLIER -74.8 -31.32 61.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.825 0.345 . . . . 1.36 110.471 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.53 60.55 2.62 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.895 -0.669 . . . . 1.02 113.23 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 7.6 p-10 -122.99 -7.02 8.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.86 110.097 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.11 10.53 68.76 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.742 -0.663 . . . . 0.67 112.965 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -142.51 129.59 20.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.883 0.373 . . . . 1.29 111.221 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.62 ' HB ' HG22 ' A' ' 136' ' ' VAL . 54.9 mt -79.68 103.04 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.941 -0.763 . . . . 0.56 108.941 178.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 43.9 t -82.0 160.62 23.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.829 -0.623 . . . . 1.33 110.255 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.5 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.01 -39.09 80.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 0.75 110.304 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.37 -35.58 81.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.89 110.558 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.35 -36.96 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.976 -0.556 . . . . 0.86 110.055 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.556 HD22 ' CG1' ' A' ' 125' ' ' ILE . 12.4 tp -66.94 -34.5 77.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.254 0.549 . . . . 0.54 109.562 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 16.1 mtm180 -70.22 -15.69 62.96 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.879 -0.6 . . . . 2.15 110.198 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.92 4.3 52.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.321 0.581 . . . . 1.21 110.13 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.2 t -114.14 -49.44 5.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.41 -0.814 . . . . 0.72 109.276 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -8.42 51.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.883 . . . . 1.6 111.826 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.458 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -72.53 -41.55 65.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.366 0.603 . . . . 1.67 109.63 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -78.12 -14.56 59.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.415 -0.812 . . . . 1.85 109.919 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 294' ' ' SER . 9.4 tt -63.54 -32.62 74.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 1.23 110.135 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.57 -62.57 0.29 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.242 -0.743 . . . . 1.13 111.242 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.53 82.31 4.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.243 0.544 . . . . 2.09 110.161 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 110' ' ' THR . 34.8 mttp -81.73 111.16 17.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.713 -0.676 . . . . 1.92 110.214 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 HD22 ' B' ' 291' ' ' LEU . 0.1 OUTLIER -85.33 175.25 9.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.334 -0.394 . . . . 1.27 110.816 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.481 ' O ' HG23 ' A' ' 121' ' ' VAL . 37.0 p -73.61 163.62 27.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.386 -0.37 . . . . 1.08 110.903 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -61.48 -31.41 71.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.956 0.408 . . . . 1.99 110.211 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -64.31 -40.26 95.56 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.48 0.657 . . . . 2.75 109.404 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 116' ' ' LEU . 46.6 mt-10 -74.44 -33.19 62.87 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.328 -0.851 . . . . 1.14 110.223 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 117' ' ' THR . 81.8 t -61.43 -40.23 85.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 108.225 -1.028 . . . . 0.86 108.225 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.23 -45.0 95.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.653 -1.158 . . . . 1.38 109.531 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.61 -38.32 90.59 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.0 -0.546 . . . . 1.94 110.204 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.607 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 6.5 mtp -59.5 -48.0 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.66 111.136 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.635 HD13 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -73.97 -35.27 41.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 C-N-CA 120.539 -0.465 . . . . 0.85 110.414 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 126' ' ' ARG . 28.5 mtm180 -64.62 -34.05 77.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.051 0.453 . . . . 1.7 110.018 178.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -73.45 -17.78 61.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.485 0.66 . . . . 1.55 109.417 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB3' HG11 ' A' ' 136' ' ' VAL . . . -108.17 8.69 28.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.378 -0.828 . . . . 0.66 110.21 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -117.17 116.03 26.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.049 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.53 -29.45 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.155 -0.475 . . . . 1.23 110.734 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.534 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 0.6 OUTLIER -77.22 -15.24 59.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 1.35 110.64 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.45 60.66 4.58 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.239 -0.505 . . . . 1.25 112.819 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.534 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.6 OUTLIER -123.66 -17.08 6.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.586 0.231 . . . . 1.06 111.468 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.05 -3.79 55.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.371 -0.918 . . . . 0.9 113.065 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -136.41 161.45 35.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.696 -0.483 . . . . 1.18 109.696 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.635 HG13 HD13 ' A' ' 125' ' ' ILE . 3.2 m -106.81 115.46 48.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 108.865 -0.791 . . . . 1.08 108.865 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.595 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.2 p30 -88.54 -176.22 5.22 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.851 -0.425 . . . . 0.84 109.851 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.405 ' OH ' ' HG3' ' A' ' 86' ' ' ARG . 18.7 t80 -59.34 -45.88 90.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.755 0.312 . . . . 1.45 111.746 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.28 -42.03 99.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.279 -0.419 . . . . 1.84 111.249 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.595 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 26.4 mt-10 -73.34 -32.17 64.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.68 110.132 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.83 -56.94 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.244 -0.889 . . . . 0.85 110.851 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.55 -33.01 55.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 115.851 -0.613 . . . . 1.23 110.807 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -38.69 90.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 1.96 111.1 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -43.37 26.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.305 -0.407 . . . . 0.89 111.421 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.488 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -66.24 -49.37 67.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.255 -0.429 . . . . 1.14 111.903 -179.178 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.32 31.14 2.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.67 121.14 10.88 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.861 -0.609 . . . . 1.64 111.448 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.497 -0.763 . . . . 3.35 109.569 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 287' ' ' ARG . . . . . 0.691 ' N ' HD22 ' B' ' 290' ' ' ASN . 52.9 mtp180 . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.799 0.333 . . . . 2.21 110.531 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 288' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.26 -47.36 82.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 1.57 111.345 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -44.36 -45.1 8.68 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 113.363 0.875 . . . . 1.18 113.363 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 290' ' ' ASN . . . . . 0.691 HD22 ' N ' ' B' ' 287' ' ' ARG . 5.1 p30 -90.72 -26.99 19.25 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.55 0.574 . . . . 1.07 112.55 -179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 291' ' ' LEU . . . . . 0.531 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -68.93 -45.12 71.61 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 120.172 -0.611 . . . . 1.52 112.624 -178.449 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 292' ' ' TRP . . . . . 0.661 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 89.5 m95 -54.68 -51.5 78.17 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 118.809 0.731 . . . . 0.48 109.739 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 36.0 Cg_exo -62.57 -18.35 63.19 Favored 'Trans proline' 0 C--N 1.363 1.321 0 C-N-CA 121.506 1.471 . . . . 0.61 112.326 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 294' ' ' SER . . . . . 0.603 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 61.6 m -58.74 -60.85 9.08 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 118.374 -0.822 . . . . 0.67 110.414 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 295' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 35.2 Cg_exo -60.94 -29.7 88.54 Favored 'Trans proline' 0 C--N 1.373 1.829 0 CA-C-N 121.359 1.521 . . . . 0.58 110.562 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 296' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 85' ' ' ILE . 7.0 tp -61.14 -44.18 97.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.095 -0.706 . . . . 0.94 109.095 177.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 30.8 ttm -64.91 -35.91 82.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.373 -0.83 . . . . 1.48 109.072 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 298' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 294' ' ' SER . 39.7 mm -61.72 -33.38 57.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.652 -0.703 . . . . 0.7 109.476 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 299' ' ' LYS . . . . . 0.413 ' HE2' ' OE2' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -64.65 -40.29 95.19 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 108.777 -0.823 . . . . 1.21 108.777 178.317 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.8 -44.69 84.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.482 -0.781 . . . . 2.51 109.34 178.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 18.2 m -64.41 -36.31 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.973 -0.558 . . . . 0.81 109.738 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -66.18 -33.38 75.62 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.901 -0.777 . . . . 2.25 108.901 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -69.26 -32.13 71.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 1.76 109.217 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -72.83 -46.09 54.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.472 -0.786 . . . . 1.62 110.009 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 116.396 -0.365 . . . . 1.68 110.029 179.37 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.854 0.359 . . . . 2.82 111.024 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.39 -45.59 90.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 2.61 111.163 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -33.72 72.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 1.78 111.481 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.475 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.6 mt -68.21 -43.09 85.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.013 0.435 . . . . 1.33 110.319 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -64.91 -47.63 77.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.661 -0.7 . . . . 2.26 110.488 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -68.73 -30.01 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.916 -0.583 . . . . 1.91 110.882 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.34 82.62 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.479 -0.328 . . . . 1.0 110.676 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.5 -38.96 75.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.034 0.445 . . . . 0.86 110.329 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -70.73 -35.5 72.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.911 -0.586 . . . . 1.84 110.526 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.463 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 98.2 t -72.49 -35.18 50.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.092 -0.504 . . . . 1.24 110.76 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -73.45 -39.05 65.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 1.06 110.09 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.677 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 25.5 t0 -80.7 103.87 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.646 -0.706 . . . . 0.95 110.776 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 2.5 mptt -94.63 -28.66 15.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.443 -0.344 . . . . 1.28 111.563 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.631 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.8 OUTLIER -77.32 -21.81 52.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.841 0.353 . . . . 1.36 111.028 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.7 57.55 4.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.032 -0.604 . . . . 1.02 113.391 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 19.8 p-10 -125.88 -1.11 7.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.046 0.451 . . . . 0.86 110.413 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.94 23.96 73.26 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.946 -0.645 . . . . 0.67 112.231 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.44 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 42.2 m-85 -142.8 139.46 30.97 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.188 0.518 . . . . 1.29 111.102 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 105' ' ' LEU . 66.7 mt -93.03 99.34 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.113 -0.949 . . . . 0.56 109.705 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.2 t -81.9 163.87 21.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.899 -0.592 . . . . 1.33 110.126 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.38 90.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.75 110.818 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -32.88 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.89 110.993 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -74.49 -41.18 61.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.436 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.66 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.9 tp -65.52 -29.91 70.61 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.392 -0.367 . . . . 0.54 110.124 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -57.0 -56.34 23.06 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.149 -0.478 . . . . 2.15 110.107 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -58.08 -35.55 71.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.864 0.364 . . . . 1.21 111.472 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.77 -56.97 10.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.3 -0.409 . . . . 0.72 111.743 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.566 ' CE ' ' HA ' ' B' ' 292' ' ' TRP . 0.8 OUTLIER -72.5 -19.73 61.48 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.114 0.783 . . . . 1.6 113.114 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.7 p -78.64 -41.79 30.52 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.122 -0.631 . . . . 1.67 110.551 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -67.33 -23.11 65.59 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.378 0.609 . . . . 1.85 109.944 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.51 -35.51 74.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.019 -0.991 . . . . 1.23 110.337 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.01 -65.38 0.56 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.667 -0.778 . . . . 1.13 112.211 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -74.9 90.19 2.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.14 0.495 . . . . 2.09 110.75 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -83.02 104.97 13.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 1.92 110.681 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 83.3 mt -91.71 175.4 6.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.11 -0.495 . . . . 1.27 110.23 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 121' ' ' VAL . 40.6 p -76.5 166.34 23.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.703 0.287 . . . . 1.08 111.368 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.46 -37.87 70.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 1.99 110.685 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.28 -44.17 95.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.048 -0.524 . . . . 2.75 110.575 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 124' ' ' MET . 37.8 mt-10 -67.9 -37.31 81.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 1.14 110.336 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.463 ' O ' ' HB2' ' A' ' 124' ' ' MET . 97.6 t -64.98 -41.45 92.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 N-CA-C 109.04 -0.726 . . . . 0.86 109.04 177.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.4 t70 -65.69 -44.26 86.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.87 -0.789 . . . . 1.38 108.87 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 127' ' ' GLU . 19.9 tt0 -53.01 -41.58 64.78 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.446 -0.797 . . . . 1.94 109.704 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.623 ' HG2' ' HB3' ' B' ' 288' ' ' ALA . 57.3 mtp -54.47 -51.0 66.41 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.07 -0.968 . . . . 0.66 110.852 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.852 HG23 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -76.49 -22.49 15.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.251 -0.58 . . . . 0.85 111.002 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 59.3 mtm-85 -65.33 -37.08 85.99 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.35 -0.611 . . . . 1.7 109.35 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' B' ' 289' ' ' ALA . 12.8 pt-20 -92.41 -1.99 56.63 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 1.55 109.988 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.599 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -107.55 5.38 26.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.511 0.672 . . . . 0.66 109.682 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 31.9 t70 -115.66 125.51 52.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.11 -0.95 . . . . 0.8 109.708 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.72 -27.12 2.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.186 -0.461 . . . . 1.23 110.791 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.61 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.0 OUTLIER -78.52 -10.34 59.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.282 -0.417 . . . . 1.35 111.072 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.48 62.51 3.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.745 -0.74 . . . . 1.25 112.426 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.644 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.1 OUTLIER -135.1 -17.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.649 0.261 . . . . 1.06 110.81 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.93 -14.92 63.97 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.901 -0.666 . . . . 0.9 113.298 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -119.26 169.21 10.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 1.18 110.632 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.852 HG13 HG23 ' A' ' 125' ' ' ILE . 27.0 m -106.09 113.7 43.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.142 0.496 . . . . 1.08 109.87 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.509 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 25.4 p30 -92.21 -177.63 4.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.349 -0.612 . . . . 0.84 109.349 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.92 -57.04 12.45 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.986 0.365 . . . . 1.45 111.986 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -57.45 -46.95 83.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 1.84 111.766 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.509 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 32.7 mt-10 -61.79 -42.92 99.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.795 0.331 . . . . 0.68 110.511 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.15 -45.39 91.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.774 -0.648 . . . . 0.85 110.114 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 70.3 t -64.29 -49.94 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.427 -0.806 . . . . 1.23 111.689 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.69 -38.6 87.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.437 0.532 . . . . 1.96 112.437 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.449 ' HE3' ' HB2' ' A' ' 128' ' ' ALA . 0.1 OUTLIER -70.4 -41.69 72.65 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.746 -0.382 . . . . 0.89 111.589 -179.09 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.513 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -74.99 -45.92 38.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.016 0.436 . . . . 1.14 111.006 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.43 77.88 1.68 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.205 -0.452 . . . . 1.53 110.749 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -91.72 126.77 36.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.123 -0.49 . . . . 1.64 110.721 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.24 -0.886 . . . . 3.35 109.784 179.775 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 109.072 -0.714 . . . . 2.21 109.072 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.623 ' HB3' ' HG2' ' A' ' 124' ' ' MET . . . -97.77 0.68 47.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.55 -0.75 . . . . 1.57 112.763 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 289' ' ' ALA . . . . . 0.532 ' HB2' ' OE1' ' A' ' 127' ' ' GLU . . . -32.23 -50.29 0.22 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.328 0.862 . . . . 1.18 113.328 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.529 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.9 p-10 -59.94 -24.29 64.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.64 0.257 . . . . 1.07 111.437 -179.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.589 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.3 tp -69.52 -25.17 63.9 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 109.332 -0.618 . . . . 1.52 109.332 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.644 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 53.5 m95 -60.88 -56.96 29.93 Favored Pre-proline 0 C--O 1.249 1.045 0 N-CA-C 106.976 -1.49 . . . . 0.48 106.976 176.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 50.2 Cg_exo -59.17 -17.85 41.08 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 121.268 1.312 . . . . 0.61 112.276 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 43.4 m -56.7 -64.73 2.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-O 118.288 -0.863 . . . . 0.67 110.923 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 31.4 Cg_exo -62.24 -26.49 77.53 Favored 'Trans proline' 0 C--N 1.372 1.79 0 CA-C-N 121.889 1.71 . . . . 0.58 110.62 176.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.8 tp -62.12 -44.42 96.67 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.583 0.706 . . . . 0.94 109.158 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 34.1 ttm -67.45 -32.88 74.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 1.48 108.923 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.52 HG12 ' O ' ' B' ' 294' ' ' SER . 40.7 mm -65.55 -32.48 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.211 -0.904 . . . . 0.7 109.191 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -45.18 94.46 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.89 -0.781 . . . . 1.21 108.89 177.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -66.68 -35.22 79.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.828 -0.624 . . . . 2.51 109.604 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 49.0 m -69.42 -36.74 76.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.81 109.736 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -66.98 -31.22 71.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 2.25 109.42 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -66.43 -42.48 87.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.691 -0.855 . . . . 1.76 108.691 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.43 -41.43 84.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.306 -0.861 . . . . 1.62 109.207 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 1.68 109.53 178.656 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.677 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.644 'CA ' ' OD1' ' A' ' 133' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.762 0.315 . . . . 2.82 111.237 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.82 -71.08 0.07 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.534 0.734 . . . . 2.61 112.659 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -63.14 -28.29 69.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 111.787 0.291 . . . . 1.78 111.787 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' B' ' 296' ' ' LEU . 0.9 OUTLIER -64.94 -48.0 85.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.23 0.538 . . . . 1.33 109.667 179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -70.6 -44.53 67.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.568 -0.742 . . . . 2.26 110.121 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 91' ' ' VAL . 42.1 mm-40 -61.02 -43.1 99.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.827 -0.624 . . . . 1.91 111.173 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.99 79.5 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.119 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -56.81 -41.37 77.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.627 -0.715 . . . . 0.86 110.64 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -68.13 -36.22 79.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.834 -0.621 . . . . 1.84 111.571 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.543 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 94.3 t -77.88 -35.83 21.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.821 0.343 . . . . 1.24 111.016 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -71.42 -33.14 69.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.504 -0.316 . . . . 1.06 110.813 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.681 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 30.1 t70 -82.9 90.01 6.91 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.607 -0.516 . . . . 0.95 109.607 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 4.6 mptt -91.64 -18.9 23.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 1.28 111.714 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.3 OUTLIER -79.46 -23.92 42.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.874 -0.33 . . . . 1.36 110.549 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.5 58.1 3.69 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.845 -0.693 . . . . 1.02 113.127 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.434 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 19.9 p-10 -126.67 -5.62 6.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.867 0.365 . . . . 0.86 110.295 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.96 17.15 77.67 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.847 -0.615 . . . . 0.67 112.751 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -143.89 139.11 29.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.703 0.287 . . . . 1.29 110.577 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.572 ' HB ' HG22 ' A' ' 136' ' ' VAL . 9.8 mt -84.76 103.12 11.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.541 -0.911 . . . . 0.56 108.541 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.506 ' HA ' ' HG2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -82.58 164.02 21.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.655 -0.702 . . . . 1.33 110.367 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -56.46 -44.41 80.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.75 111.044 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -41.33 96.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.045 0.45 . . . . 0.89 110.739 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 108' ' ' VAL . 47.7 mt-10 -67.49 -41.77 83.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.745 -0.662 . . . . 0.86 110.469 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 16.3 tp -67.31 -32.33 73.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.287 -0.415 . . . . 0.54 110.245 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.493 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 30.3 mtm-85 -57.97 -39.44 78.16 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.638 -0.504 . . . . 2.15 109.638 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -71.31 -33.48 69.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.519 . . . . 1.21 110.106 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 104' ' ' GLU . 96.0 t -62.15 -49.15 85.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.09 -0.505 . . . . 0.72 110.07 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.498 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.2 OUTLIER -66.26 -34.0 77.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 1.6 110.683 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.2 m -64.19 -45.72 87.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.912 0.386 . . . . 1.67 110.22 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -73.98 -24.25 59.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 1.85 110.26 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' B' ' 294' ' ' SER . 17.8 tp -63.69 -31.77 73.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.673 -0.694 . . . . 1.23 110.302 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.01 -40.17 2.61 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.786 -0.721 . . . . 1.13 112.071 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.68 98.0 5.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 2.09 110.474 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -89.14 100.52 13.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 1.92 110.337 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.84 -174.29 2.5 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.818 -0.628 . . . . 1.27 110.824 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 43.8 p -78.19 165.17 24.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 1.08 110.722 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.493 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 18.9 t70 -63.79 -37.63 88.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.326 -0.397 . . . . 1.99 110.737 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -66.0 -31.85 72.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.134 -0.484 . . . . 2.75 110.386 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -67.38 -37.95 83.95 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.157 -0.683 . . . . 1.14 109.157 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' A' ' 124' ' ' MET . 58.6 t -67.72 -36.33 75.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.638 -0.875 . . . . 0.86 108.638 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -65.87 -43.3 88.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.197 -0.91 . . . . 1.38 108.896 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -57.7 -38.84 75.89 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.802 -0.814 . . . . 1.94 108.802 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.692 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 38.8 mtp -58.18 -52.27 66.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.177 -0.92 . . . . 0.66 111.276 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.655 HD13 HG13 ' A' ' 136' ' ' VAL . 1.5 mm -68.67 -34.86 67.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 120.753 -0.379 . . . . 0.85 110.485 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -64.38 -29.65 70.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.947 0.403 . . . . 1.7 110.121 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.52 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 4.5 tt0 -86.14 -27.08 24.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.531 -0.759 . . . . 1.55 110.664 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -89.31 -26.12 21.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.061 -0.518 . . . . 0.66 112.027 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.662 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 30.0 t0 -90.59 109.71 20.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.981 0.419 . . . . 0.8 109.967 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 6.1 mt -100.68 -31.43 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.875 -0.602 . . . . 1.23 111.134 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.61 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -75.56 -20.16 58.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.773 0.321 . . . . 1.35 111.447 -179.034 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.84 61.87 2.33 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.666 -0.778 . . . . 1.25 113.005 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.626 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.5 p-10 -121.72 -14.11 8.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.858 0.361 . . . . 1.06 110.269 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.67 -11.41 61.11 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.076 -0.583 . . . . 0.9 112.632 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 101' ' ' SER . 16.5 mt-30 -132.29 165.35 24.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.329 0.585 . . . . 1.18 110.853 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.655 HG13 HD13 ' A' ' 125' ' ' ILE . 4.6 m -106.8 124.9 62.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.79 -0.819 . . . . 1.08 108.79 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.557 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.8 p30 -103.54 -178.46 3.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.442 -0.345 . . . . 0.84 110.348 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 142' ' ' VAL . 68.9 t80 -59.2 -44.18 92.23 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 111.914 0.339 . . . . 1.45 111.914 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -61.97 -46.08 90.85 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.698 0.285 . . . . 1.84 111.524 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.557 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 31.7 mt-10 -72.29 -32.24 66.43 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.123 0.487 . . . . 0.68 110.384 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 10.3 t80 -58.89 -52.73 64.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.351 -0.84 . . . . 0.85 111.56 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 138' ' ' TYR . 44.7 t -60.82 -36.48 71.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.488 . . . . 1.23 111.463 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.0 -25.76 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.41 . . . . 1.96 111.912 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.52 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -73.15 -56.46 5.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.075 0.464 . . . . 0.89 110.901 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.555 ' HG2' HD22 ' B' ' 296' ' ' LEU . 2.0 mpt? -68.46 -53.29 24.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.814 -0.63 . . . . 1.14 111.244 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 73.77 10.02 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.931 0.396 . . . . 1.53 110.956 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 65.98 6.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 1.64 110.908 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 41.0 mmtt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.697 -0.668 . . . . 3.35 110.287 -179.971 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.572 ' HA ' ' CZ ' ' B' ' 287' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 109.906 -0.405 . . . . 2.21 109.906 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.692 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -111.17 -28.76 8.14 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.861 0.689 . . . . 1.57 112.861 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.39 -33.95 9.99 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 1.18 112.54 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 21.5 p-10 -92.1 -30.68 15.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 111.967 0.358 . . . . 1.07 111.967 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.782 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 6.1 tp -72.79 -41.71 64.71 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 113.426 0.899 . . . . 1.52 113.426 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' A' ' 136' ' ' VAL . 77.0 m95 -56.61 -50.87 85.36 Favored Pre-proline 0 C--O 1.247 0.954 0 CA-C-N 119.918 1.236 . . . . 0.48 108.989 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 44.6 Cg_exo -60.53 -21.71 69.44 Favored 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 121.591 1.527 . . . . 0.61 111.877 176.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 66.6 m -55.84 -65.27 1.6 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-O 118.523 -0.751 . . . . 0.67 110.809 179.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.782 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 13.5 Cg_endo -60.02 -31.21 93.17 Favored 'Trans proline' 0 C--N 1.368 1.589 0 CA-C-N 121.345 1.516 . . . . 0.58 111.665 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.602 HD11 ' HA ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -64.79 -44.79 88.8 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.004 -0.678 . . . . 0.94 109.926 178.47 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 43.4 ttm -69.39 -35.37 75.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.115 -0.698 . . . . 1.48 109.115 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' B' ' 295' ' ' PRO . 22.8 mm -65.62 -30.49 50.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.333 -0.849 . . . . 0.7 109.118 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -68.08 -39.03 82.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.076 -0.713 . . . . 1.21 109.076 178.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -65.17 -36.63 84.81 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.264 -1.013 . . . . 2.51 108.264 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 10.9 m -71.55 -32.63 68.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.013 -0.994 . . . . 0.81 109.291 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -69.2 -38.62 78.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.464 -0.939 . . . . 2.25 108.464 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -60.27 -42.43 95.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.307 -0.998 . . . . 1.76 108.307 177.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -62.54 -41.22 98.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.922 -1.035 . . . . 1.62 109.086 177.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.292 -0.867 . . . . 1.68 110.263 179.405 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.681 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.662 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.891 0.377 . . . . 2.82 110.583 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -58.35 8.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.864 -0.607 . . . . 2.61 111.495 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.46 -31.86 68.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.531 -0.304 . . . . 1.78 111.548 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.559 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.1 mt -66.36 -42.7 91.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.923 0.392 . . . . 1.33 110.479 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -65.1 -41.09 95.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.395 0.617 . . . . 2.26 109.433 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -68.02 -39.85 83.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.691 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.44 -41.84 77.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.024 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -57.77 -38.76 75.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.072 -0.513 . . . . 0.86 110.818 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -74.71 -40.02 61.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.183 -0.462 . . . . 1.84 111.006 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.25 -36.94 78.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 1.24 111.052 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -73.72 -40.03 63.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.41 . . . . 1.06 110.192 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.665 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 31.0 t70 -81.98 75.55 8.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.415 0.626 . . . . 0.95 110.175 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -77.74 -21.62 51.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.394 -0.821 . . . . 1.28 111.225 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.1 OUTLIER -77.97 -13.05 60.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.566 -0.288 . . . . 1.36 110.786 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 63.5 63.95 4.1 Favored Glycine 0 C--N 1.333 0.363 0 CA-C-N 115.925 -0.579 . . . . 1.02 112.962 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 99' ' ' TYR . 0.4 OUTLIER -132.57 -8.62 3.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.871 0.367 . . . . 0.86 110.528 -179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.71 15.75 74.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.14 -0.552 . . . . 0.67 113.937 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.595 ' HB2' HD21 ' A' ' 97' ' ' ASN . 94.5 m-85 -144.76 133.62 22.45 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.422 0.611 . . . . 1.29 110.929 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.474 HG21 HD13 ' A' ' 105' ' ' LEU . 33.6 mt -81.99 112.58 20.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.839 -0.618 . . . . 0.56 109.62 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.5 p -95.67 172.97 7.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 1.33 110.166 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.88 92.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.659 0.266 . . . . 0.75 110.298 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.03 76.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.89 111.092 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.516 ' OE2' ' HA ' ' A' ' 93' ' ' ASP . 49.1 mt-10 -63.01 -36.83 84.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.987 -0.551 . . . . 0.86 111.166 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.571 HD22 ' CD1' ' A' ' 125' ' ' ILE . 7.0 tp -76.73 -34.54 58.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.643 -0.253 . . . . 0.54 111.02 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.413 ' NE ' HG11 ' A' ' 121' ' ' VAL . 36.1 mtt180 -58.81 -37.31 76.12 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.705 -0.48 . . . . 2.15 109.705 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.0 -23.05 65.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.493 -0.776 . . . . 1.21 110.62 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.6 t -83.04 -47.35 18.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.929 -0.578 . . . . 0.72 110.564 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.6 mmt -66.27 -30.42 70.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.81 -0.632 . . . . 1.6 112.091 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -41.5 86.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.043 0.449 . . . . 1.67 110.247 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.77 -27.76 62.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.763 -0.653 . . . . 1.85 109.555 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.4 tp -63.3 -39.49 94.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.309 -0.859 . . . . 1.23 109.703 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.88 -31.16 4.85 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.63 -0.714 . . . . 1.13 111.608 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.0 93.07 7.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.373 0.606 . . . . 2.09 110.695 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -87.86 95.83 10.25 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.516 -0.766 . . . . 1.92 109.336 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.92 163.57 17.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.964 -0.562 . . . . 1.27 111.148 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.7 p -81.24 169.35 17.43 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.836 -0.62 . . . . 1.08 110.05 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -36.03 70.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.875 0.369 . . . . 1.99 110.969 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.0 -46.72 76.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 2.75 110.421 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.03 -37.36 83.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.891 -0.595 . . . . 1.14 110.636 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 117' ' ' THR . 69.6 t -63.23 -32.25 55.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.954 0.407 . . . . 0.86 110.0 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.5 -53.0 61.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.028 -0.533 . . . . 1.38 109.784 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 126' ' ' ARG . 19.6 tt0 -67.75 -26.79 66.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.091 -0.504 . . . . 1.94 110.059 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.758 ' HE3' ' HB3' ' B' ' 291' ' ' LEU . 0.0 OUTLIER -52.87 -53.76 44.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.746 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.571 ' CD1' HD22 ' A' ' 105' ' ' LEU . 1.1 mt -89.36 -18.98 7.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.363 -0.535 . . . . 0.85 110.586 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 123' ' ' GLU . 14.2 ttm180 -65.16 -35.47 81.2 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 108.916 -0.772 . . . . 1.7 108.916 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.422 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 7.0 tt0 -74.42 -16.32 60.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.952 -1.022 . . . . 1.55 109.19 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.63 31.81 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.19 -0.913 . . . . 0.66 110.594 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.643 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 21.1 t0 -112.36 112.95 24.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.401 0.619 . . . . 0.8 110.331 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mt -106.11 -36.78 3.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.358 -0.837 . . . . 1.23 110.817 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.42 -29.99 64.22 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.749 0.277 . . . . 1.35 111.749 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 93.46 21.95 27.98 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.543 -0.837 . . . . 1.25 112.367 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.619 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.6 p-10 -89.11 -9.32 51.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.903 0.383 . . . . 1.06 110.716 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.69 -2.74 85.29 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.955 -0.64 . . . . 0.9 112.944 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.577 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 12.6 mt-30 -120.38 169.76 10.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.959 0.409 . . . . 1.18 110.284 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.662 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -116.12 105.29 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.466 -0.788 . . . . 1.08 109.309 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.578 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.6 p30 -95.73 175.71 6.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.808 -0.633 . . . . 0.84 109.958 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.443 ' O ' HG23 ' A' ' 142' ' ' VAL . 50.2 t80 -51.61 -45.33 63.17 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.467 0.479 . . . . 1.45 111.624 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.79 -50.4 74.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.707 -0.679 . . . . 1.84 112.028 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.578 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 23.6 mt-10 -72.74 -32.8 65.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.076 0.465 . . . . 0.68 111.197 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.8 -53.17 59.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.85 112.085 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 138' ' ' TYR . 61.9 t -61.23 -40.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 111.961 0.356 . . . . 1.23 111.961 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -67.47 -28.44 67.86 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.197 -0.201 . . . . 1.96 111.485 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.422 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -64.2 -48.94 73.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.142 0.496 . . . . 0.89 110.907 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.728 ' HG2' HD22 ' B' ' 296' ' ' LEU . 1.9 mpt? -77.27 -36.42 54.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.952 -0.567 . . . . 1.14 111.25 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.7 55.92 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.235 0.541 . . . . 1.53 110.554 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.18 127.89 32.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.478 -0.783 . . . . 1.64 110.605 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.945 -0.57 . . . . 3.35 110.128 179.743 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 110.197 -0.297 . . . . 2.21 110.197 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.503 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -90.23 -30.56 17.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.905 0.383 . . . . 1.57 110.532 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -49.21 -39.0 28.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.202 -0.908 . . . . 1.18 112.686 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.443 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.0 p-10 -88.5 -22.96 23.36 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.013 0.375 . . . . 1.07 112.013 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.758 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 6.9 tp -73.57 -43.27 60.23 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 118.739 -0.648 . . . . 1.52 111.878 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.662 ' CH2' HG21 ' A' ' 136' ' ' VAL . 66.6 m95 -52.96 -52.47 64.89 Favored Pre-proline 0 CA--C 1.552 1.044 0 CA-C-N 119.262 0.937 . . . . 0.48 109.663 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 41.4 Cg_exo -60.33 -23.16 73.65 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.861 1.708 . . . . 0.61 112.028 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 50.9 m -55.93 -64.79 1.93 Allowed Pre-proline 0 CA--C 1.546 0.821 0 CA-C-O 118.355 -0.831 . . . . 0.67 110.834 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 51.5 Cg_exo -57.85 -31.74 93.22 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 121.572 1.597 . . . . 0.58 111.561 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.728 HD22 ' HG2' ' A' ' 145' ' ' MET . 2.6 tp -61.15 -46.16 91.69 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.195 0.522 . . . . 0.94 109.681 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 51.0 ttm -66.99 -39.1 87.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.799 -0.637 . . . . 1.48 109.47 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.523 HG12 ' O ' ' B' ' 294' ' ' SER . 30.7 mm -61.73 -32.43 53.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.734 . . . . 0.7 109.944 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -66.85 -45.97 76.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.06 -0.518 . . . . 1.21 110.246 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.82 -34.22 77.66 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.458 -0.571 . . . . 2.51 109.458 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 15.3 m -70.73 -34.78 72.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.573 -0.739 . . . . 0.81 109.197 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -69.98 -34.89 73.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.183 -0.673 . . . . 2.25 109.183 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -63.33 -40.08 96.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.388 -0.968 . . . . 1.76 108.388 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -69.13 -38.18 78.7 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.815 -1.084 . . . . 1.62 109.417 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-N 115.649 -0.705 . . . . 1.68 109.471 178.275 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.665 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.643 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 121.088 0.471 . . . . 2.82 110.862 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -53.93 -49.46 68.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.338 -0.846 . . . . 2.61 111.555 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.54 -44.57 89.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.769 0.318 . . . . 1.78 111.116 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.413 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -62.74 -45.91 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 1.33 110.821 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -63.52 -43.91 95.79 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 2.26 110.047 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.444 ' O ' HG23 ' A' ' 91' ' ' VAL . 19.9 mm-40 -64.09 -42.35 96.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 1.91 110.841 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.95 81.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.306 -0.407 . . . . 1.0 110.146 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -59.85 -38.58 82.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.949 -0.569 . . . . 0.86 110.168 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -65.46 -37.26 86.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 1.84 110.911 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.3 t -75.96 -35.54 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.089 0.471 . . . . 1.24 110.706 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -71.42 -36.93 71.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 1.06 110.54 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.644 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 28.7 t70 -81.06 84.46 6.5 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.765 -0.457 . . . . 0.95 109.765 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -85.89 -22.8 27.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.563 -0.744 . . . . 1.28 112.142 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.621 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 4.6 p-10 -82.32 -11.0 58.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.977 0.418 . . . . 1.36 110.97 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.65 48.04 71.32 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.887 -0.597 . . . . 1.02 113.692 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -115.13 -6.1 12.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.99 0.395 . . . . 0.86 110.536 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 79.54 14.13 81.67 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.944 -0.646 . . . . 0.67 112.722 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -139.16 149.54 44.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.703 0.287 . . . . 1.29 110.747 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.467 ' HB ' HG12 ' A' ' 136' ' ' VAL . 6.0 mt -94.4 103.16 14.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.956 -0.757 . . . . 0.56 108.956 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -83.56 162.47 20.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.579 -0.737 . . . . 1.33 109.442 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.51 -36.13 73.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.004 0.43 . . . . 0.75 110.399 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.92 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.89 110.555 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' A' ' 93' ' ' ASP . 45.0 mt-10 -67.64 -40.37 84.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 0.86 110.825 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 5.0 tp -75.12 -26.03 58.89 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.11 0.481 . . . . 0.54 110.258 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -68.09 -13.86 62.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.238 -0.653 . . . . 2.15 109.238 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -106.33 15.78 25.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.083 -0.962 . . . . 1.21 109.024 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 104' ' ' GLU . 74.7 t -120.04 -54.92 3.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.445 -0.798 . . . . 0.72 109.622 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.571 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -69.0 -12.39 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.381 -0.827 . . . . 1.6 111.301 -179.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -37.34 68.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.159 -0.682 . . . . 1.67 109.159 178.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -79.03 -16.74 56.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.953 -1.021 . . . . 1.85 109.115 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 109' ' ' MET . 45.5 tp -67.04 -17.24 64.81 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.06 -0.973 . . . . 1.23 109.825 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 104.29 -70.52 0.26 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.667 -0.697 . . . . 1.13 112.128 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -61.78 106.33 0.67 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.989 0.423 . . . . 2.09 111.158 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -100.29 91.45 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.023 -0.535 . . . . 1.92 109.795 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.2 mt -77.33 178.84 6.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.281 -0.872 . . . . 1.27 111.105 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -77.8 172.28 13.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.349 . . . . 1.08 111.699 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -56.09 -48.57 75.88 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.093 -0.503 . . . . 1.99 111.802 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -64.49 -35.06 79.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 2.75 111.055 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.81 -39.61 79.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.884 0.373 . . . . 1.14 110.081 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.8 t -68.65 -36.89 76.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.975 -0.75 . . . . 0.86 108.975 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 4.0 t70 -63.21 -47.71 81.37 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.454 -0.943 . . . . 1.38 108.454 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.592 ' HG2' ' NH2' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -56.49 -37.3 70.2 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.388 -0.824 . . . . 1.94 109.948 178.55 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.605 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 2.5 mtp -55.43 -50.26 70.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.278 -0.874 . . . . 0.66 111.29 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.578 HG23 HG23 ' A' ' 136' ' ' VAL . 0.9 OUTLIER -79.49 -27.01 12.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.124 -0.63 . . . . 0.85 110.946 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.592 ' NH2' ' HG2' ' A' ' 123' ' ' GLU . 80.1 mtm-85 -63.84 -31.35 72.5 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 108.273 -1.01 . . . . 1.7 108.273 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -72.78 -29.38 63.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 114.861 -1.063 . . . . 1.55 109.459 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.42 -0.24 54.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.415 -0.812 . . . . 0.66 111.528 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 20.7 t0 -106.9 116.41 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.265 0.555 . . . . 0.8 110.5 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.4 mt -109.51 -32.15 2.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.779 -0.646 . . . . 1.23 110.725 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -77.79 -14.93 59.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.883 0.373 . . . . 1.35 110.826 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.2 30.87 64.48 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.039 -0.601 . . . . 1.25 112.259 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.615 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -89.67 -10.83 44.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.014 0.435 . . . . 1.06 110.378 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 -12.57 68.72 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.141 -0.552 . . . . 0.9 112.753 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.429 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 6.1 mt-30 -120.67 173.08 7.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 1.18 110.929 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.635 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -115.86 105.92 19.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.673 -0.694 . . . . 1.08 109.752 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.539 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 2.2 p30 -90.3 173.09 8.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.363 -0.381 . . . . 0.84 110.039 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -52.37 -44.89 65.51 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.308 0.38 . . . . 1.45 111.623 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -57.2 -55.11 38.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 1.84 111.199 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.539 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 33.8 mt-10 -64.72 -42.75 95.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.327 -0.397 . . . . 0.68 110.565 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -53.51 -58.0 8.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.647 -0.706 . . . . 0.85 111.436 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 65.1 t -65.81 -51.95 55.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.069 -0.514 . . . . 1.23 111.953 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -56.65 -42.82 79.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.724 0.638 . . . . 1.96 112.724 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -41.3 96.71 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.945 0.35 . . . . 0.89 111.945 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.504 ' SD ' HD22 ' B' ' 296' ' ' LEU . 10.1 mtt -81.25 -31.02 33.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.412 -0.358 . . . . 1.14 111.351 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.2 m -87.98 59.9 5.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.429 0.633 . . . . 1.53 110.596 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 137.14 36.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.448 -0.796 . . . . 1.64 110.237 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.094 -0.955 . . . . 3.35 109.974 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 109.92 -0.4 . . . . 2.21 109.92 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -116.9 -15.01 10.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.15 -0.477 . . . . 1.57 110.8 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -59.46 -18.84 43.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.399 -0.819 . . . . 1.18 112.594 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.422 ' ND2' HD12 ' B' ' 291' ' ' LEU . 13.7 p-10 -91.11 -32.03 16.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 120.822 0.344 . . . . 1.07 111.527 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.477 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.8 mp -70.09 -42.58 72.54 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 118.937 -0.554 . . . . 1.52 111.441 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' A' ' 136' ' ' VAL . 65.5 m95 -53.48 -54.63 43.47 Favored Pre-proline 0 CA--C 1.555 1.165 0 CA-C-N 118.915 0.779 . . . . 0.48 110.387 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 43.6 Cg_exo -60.75 -20.11 64.32 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.822 1.681 . . . . 0.61 112.229 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 73.9 m -58.5 -64.2 3.13 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.987 -1.006 . . . . 0.67 110.116 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 75.9 Cg_exo -54.57 -31.77 71.44 Favored 'Trans proline' 0 C--N 1.372 1.801 0 CA-C-N 121.978 1.742 . . . . 0.58 111.374 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.504 HD22 ' SD ' ' A' ' 145' ' ' MET . 6.0 tp -61.62 -48.11 82.36 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.592 0.711 . . . . 0.94 109.5 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 32.9 ttm -67.73 -30.21 69.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.625 -0.716 . . . . 1.48 109.232 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.564 HG12 ' O ' ' B' ' 294' ' ' SER . 40.2 mm -68.36 -28.72 41.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 108.886 -0.783 . . . . 0.7 108.886 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -39.95 92.0 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.992 -1.114 . . . . 1.21 107.992 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -66.2 -40.22 90.24 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.454 -0.794 . . . . 2.51 109.093 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 7.2 m -68.39 -36.22 78.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.407 -0.815 . . . . 0.81 109.551 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -69.47 -34.7 74.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.497 -0.774 . . . . 2.25 109.36 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -33.49 75.44 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.572 -0.899 . . . . 1.76 108.572 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -72.38 -46.56 54.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.301 -0.863 . . . . 1.62 109.498 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 N--CA 1.456 -0.145 0 CA-C-N 116.071 -0.513 . . . . 1.68 109.914 179.056 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.644 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.655 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.722 0.296 . . . . 2.82 110.472 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.48 -48.39 77.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.562 -0.29 . . . . 2.61 111.619 -178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.28 -43.07 92.56 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.771 0.286 . . . . 1.78 111.771 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 mt -66.2 -43.63 91.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.832 0.348 . . . . 1.33 110.796 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 86' ' ' ARG . 38.5 ttt-85 -62.62 -42.26 99.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.003 -0.544 . . . . 2.26 110.642 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 91' ' ' VAL . 70.9 tt0 -75.23 -33.09 61.3 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 1.91 111.167 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.61 -45.35 81.51 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.824 0.345 . . . . 1.0 110.427 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -60.56 -39.13 86.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.883 -0.599 . . . . 0.86 110.436 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.435 ' NH2' ' HA2' ' A' ' 96' ' ' GLY . 6.8 tpm_? -67.63 -31.32 71.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 1.84 110.771 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.1 t -78.53 -42.96 26.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 1.24 111.239 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.08 -40.76 82.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 1.06 110.91 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.67 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 32.5 t70 -79.78 76.93 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.044 -0.724 . . . . 0.95 109.044 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -71.07 -28.54 64.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.225 -0.898 . . . . 1.28 111.441 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.645 ' OD2' 'CA ' ' A' 1000 ' ' ' CA' . 0.0 OUTLIER -70.11 -24.17 63.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.78 -0.368 . . . . 1.36 110.473 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.435 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 71.3 58.42 5.54 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.063 -0.589 . . . . 1.02 113.856 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.448 ' HB3' ' OD1' ' A' ' 95' ' ' ASP . 14.9 p-10 -128.72 -8.12 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.234 0.54 . . . . 0.86 110.677 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.46 65.65 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.553 -0.832 . . . . 0.67 112.151 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.583 ' CE1' ' HB3' ' A' ' 137' ' ' ASN . 40.2 m-85 -140.38 124.87 17.89 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.586 0.232 . . . . 1.29 110.611 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 HD13 ' A' ' 105' ' ' LEU . 8.0 mt -79.03 102.79 5.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.917 -0.772 . . . . 0.56 108.917 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.3 m -77.55 161.95 27.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.51 -0.768 . . . . 1.33 110.408 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.95 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.422 . . . . 0.75 110.522 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.81 71.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 0.89 111.132 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -75.99 -41.56 50.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 0.86 110.388 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.592 HD13 HG21 ' A' ' 100' ' ' ILE . 5.5 tp -74.63 -31.64 62.05 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.199 -0.455 . . . . 0.54 111.191 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.465 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 50.3 mtm-85 -57.16 -35.62 69.77 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.224 0.535 . . . . 2.15 110.041 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -69.53 -36.92 76.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.766 -0.652 . . . . 1.21 109.319 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.0 t -66.31 -41.15 88.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.427 -0.806 . . . . 0.72 109.792 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -27.12 69.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.062 0.458 . . . . 1.6 110.604 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 21.7 m -71.49 -35.11 70.68 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.317 0.579 . . . . 1.67 109.565 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -88.09 -3.04 58.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.659 -0.701 . . . . 1.85 109.856 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.8 tp -85.79 -0.49 55.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.296 -0.866 . . . . 1.23 110.13 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.31 -62.81 4.43 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.714 -0.675 . . . . 1.13 111.724 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -74.64 96.13 2.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.987 0.423 . . . . 2.09 110.615 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -81.02 99.35 8.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 1.92 109.917 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.7 mt -90.53 167.1 12.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.606 -0.725 . . . . 1.27 110.668 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.4 p -73.06 166.19 23.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.347 -0.388 . . . . 1.08 110.909 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.465 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 27.9 t0 -57.91 -43.06 85.94 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.511 0.189 . . . . 1.99 111.511 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -62.45 -35.32 78.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.667 0.27 . . . . 2.75 110.546 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -69.36 -38.64 78.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.779 -0.452 . . . . 1.14 109.779 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 117' ' ' THR . 55.5 t -68.26 -36.88 76.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.907 -0.775 . . . . 0.86 108.907 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -64.02 -42.65 97.06 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.897 -0.779 . . . . 1.38 108.897 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.53 -34.51 77.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.252 -0.885 . . . . 1.94 109.186 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.754 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 4.8 mtp -61.21 -50.1 74.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.66 110.683 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.755 HG23 HG13 ' A' ' 136' ' ' VAL . 0.7 OUTLIER -75.43 -24.38 17.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.771 -0.372 . . . . 0.85 110.388 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -66.78 -29.46 69.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.657 -0.868 . . . . 1.7 108.657 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -82.76 -20.7 35.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.826 -1.079 . . . . 1.55 109.558 178.513 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -99.91 -2.36 34.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.666 -0.697 . . . . 0.66 111.363 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.654 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 29.0 t70 -106.47 112.15 25.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.147 -0.479 . . . . 0.8 109.794 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mt -107.68 -22.47 4.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.229 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.62 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 3.2 p-10 -85.39 -13.43 49.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.808 0.337 . . . . 1.35 111.677 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.01 45.08 12.22 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.94 -0.648 . . . . 1.25 113.559 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.643 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.4 OUTLIER -112.45 -13.52 13.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.008 0.433 . . . . 1.06 110.301 179.369 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.47 -36.92 3.96 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.801 -0.714 . . . . 0.9 112.745 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -107.67 172.3 6.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.066 0.46 . . . . 1.18 110.894 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.755 HG13 HG23 ' A' ' 125' ' ' ILE . 17.0 m -107.73 118.59 55.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.206 -0.664 . . . . 1.08 109.206 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.583 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.1 p30 -92.83 177.2 6.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.669 -0.493 . . . . 0.84 109.669 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -50.19 -49.1 53.58 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 123.192 0.308 . . . . 1.45 111.783 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.91 -54.98 41.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 1.84 111.257 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.0 -42.73 98.98 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.391 -0.368 . . . . 0.68 111.007 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -53.54 -55.28 26.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.69 -0.686 . . . . 0.85 111.121 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 56.2 t -69.98 -41.1 79.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.979 -0.555 . . . . 1.23 111.892 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.76 -43.99 87.2 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.517 0.562 . . . . 1.96 112.517 -178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.4 tmt? -67.28 -45.24 77.2 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.862 0.319 . . . . 0.89 111.862 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.434 ' SD ' HD13 ' B' ' 296' ' ' LEU . 29.5 mtt -72.85 -50.89 21.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.235 -0.438 . . . . 1.14 111.844 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -90.01 50.47 1.88 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.46 0.648 . . . . 1.53 111.158 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.02 66.06 4.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.75 -0.659 . . . . 1.64 110.301 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.251 -0.881 . . . . 3.35 109.747 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.022 -0.362 . . . . 2.21 110.022 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.754 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -46.33 -40.51 11.92 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.604 0.565 . . . . 1.57 112.215 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -47.6 -45.4 27.46 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.837 0.711 . . . . 1.18 112.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -91.56 -22.71 20.2 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 112.307 0.484 . . . . 1.07 112.307 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.471 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 0.1 OUTLIER -68.76 -55.5 11.08 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 118.668 -0.682 . . . . 1.52 112.067 -178.539 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.605 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 84.0 m95 -49.1 -52.48 47.39 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 118.867 0.758 . . . . 0.48 110.869 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 57.6 Cg_exo -56.69 -28.47 75.66 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 122.035 1.823 . . . . 0.61 112.901 178.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 38.1 m -56.35 -62.72 4.35 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-O 118.358 -0.83 . . . . 0.67 110.915 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 64.8 Cg_exo -55.14 -31.63 76.39 Favored 'Trans proline' 0 C--N 1.369 1.645 0 CA-C-N 121.297 1.499 . . . . 0.58 111.677 176.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.434 HD13 ' SD ' ' A' ' 145' ' ' MET . 10.4 tp -64.82 -42.88 94.62 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.546 0.689 . . . . 0.94 109.487 178.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 46.0 ttm -66.25 -31.04 71.61 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.399 -0.963 . . . . 1.48 108.399 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 294' ' ' SER . 38.6 mm -64.85 -30.51 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 115.135 -0.939 . . . . 0.7 109.537 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -39.05 87.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.235 -1.024 . . . . 1.21 108.235 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -61.38 -43.53 98.71 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.336 -0.987 . . . . 2.51 108.336 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.6 m -67.12 -34.69 78.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.81 110.133 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 302' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 302' ' ' LYS . 25.5 tptt -68.78 -32.27 71.88 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.467 -0.568 . . . . 2.25 109.467 178.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -63.92 -36.46 84.03 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.747 -1.205 . . . . 1.76 107.747 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -66.63 -39.64 88.38 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.628 -1.169 . . . . 1.62 108.77 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-N 115.731 -0.668 . . . . 1.68 109.946 178.584 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.67 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.654 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 120.794 0.33 . . . . 2.82 110.772 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.39 -39.36 85.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.401 -0.363 . . . . 2.61 111.639 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.21 -43.73 83.04 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.024 0.44 . . . . 1.78 109.961 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.39 -46.2 81.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.496 -0.775 . . . . 1.33 110.983 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -63.25 -44.64 94.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.739 0.304 . . . . 2.26 110.773 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 91' ' ' VAL . 30.7 tt0 -65.03 -40.6 95.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.092 -0.504 . . . . 1.91 110.149 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.74 -46.68 81.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.08 -42.7 86.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.628 -0.715 . . . . 0.86 110.33 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -65.34 -42.97 92.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.838 -0.619 . . . . 1.84 111.162 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.523 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 89.8 t -68.33 -34.51 66.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.177 -0.465 . . . . 1.24 110.866 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.71 -38.16 64.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.33 -0.396 . . . . 1.06 110.126 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 32.0 t70 -82.48 81.59 8.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.362 0.601 . . . . 0.95 109.88 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 8.6 mttt -81.73 -15.9 52.89 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.507 -0.769 . . . . 1.28 111.766 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.2 OUTLIER -81.77 -26.74 34.19 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.603 -0.439 . . . . 1.36 110.473 -179.425 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.46 23.39 40.13 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.805 -0.712 . . . . 1.02 114.848 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.428 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 12.7 p-10 -96.92 -8.51 30.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.781 0.791 . . . . 0.86 111.127 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.05 20.8 66.8 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.772 -0.728 . . . . 0.67 112.334 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -144.62 130.67 19.43 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.888 -0.412 . . . . 1.29 109.888 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.597 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 65.7 mt -76.44 102.21 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.163 -0.68 . . . . 0.56 109.163 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -81.27 165.72 21.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.12 -0.491 . . . . 1.33 109.692 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.59 68.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.802 0.334 . . . . 0.75 111.283 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.77 -42.41 70.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.072 0.463 . . . . 0.89 110.199 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 108' ' ' VAL . 41.4 mt-10 -70.16 -37.06 75.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.556 -0.747 . . . . 0.86 110.304 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.679 HD22 HG12 ' A' ' 125' ' ' ILE . 19.2 tp -67.88 -29.39 68.48 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.329 0.585 . . . . 0.54 109.782 178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -76.91 5.11 8.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.461 -0.79 . . . . 2.15 109.926 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -125.31 16.2 8.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.303 -0.862 . . . . 1.21 109.066 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 104' ' ' GLU . 94.0 t -120.59 -66.87 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.633 -0.712 . . . . 0.72 110.535 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.478 ' HG2' ' SD ' ' A' ' 124' ' ' MET . 0.8 OUTLIER -67.77 -18.88 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.672 -0.695 . . . . 1.6 111.323 -178.788 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -45.88 51.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.653 0.74 . . . . 1.67 109.383 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.87 -25.29 65.45 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 114.972 -1.013 . . . . 1.85 109.389 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.472 HD22 ' HD3' ' B' ' 295' ' ' PRO . 11.6 tp -60.28 -25.59 65.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.865 -1.061 . . . . 1.23 110.554 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.98 -35.18 4.28 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.921 -0.657 . . . . 1.13 111.903 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -66.91 102.64 0.99 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.0 0.429 . . . . 2.09 111.001 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -85.2 85.51 7.46 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.897 -0.592 . . . . 1.92 109.901 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.425 HD11 HD22 ' B' ' 291' ' ' LEU . 73.0 mt -95.57 162.61 13.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.577 -0.738 . . . . 1.27 111.45 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 22.3 p -87.14 170.56 11.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.352 -0.84 . . . . 1.08 110.524 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -55.94 -42.7 76.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 1.99 110.921 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.55 -39.89 92.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.288 -0.415 . . . . 2.75 110.753 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.87 -37.23 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 1.14 110.248 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 124' ' ' MET . 56.1 t -67.19 -36.24 76.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.8 -0.815 . . . . 0.86 108.8 177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 23.5 t70 -63.59 -43.12 97.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.34 -0.846 . . . . 1.38 109.395 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.11 -34.69 78.16 Favored 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 109.406 -0.59 . . . . 1.94 109.406 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.689 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 5.6 mtp -60.07 -50.77 72.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.565 -0.743 . . . . 0.66 110.499 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.967 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -75.45 -22.81 16.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.664 -0.414 . . . . 0.85 110.197 179.432 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 10.2 ttm180 -67.05 -23.6 65.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.289 -0.634 . . . . 1.7 109.289 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -92.55 -19.39 22.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.036 -0.984 . . . . 1.55 110.729 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -97.44 -41.22 8.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.893 0.331 . . . . 0.66 111.893 -179.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.645 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 19.6 t0 -79.87 106.99 12.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.22 0.534 . . . . 0.8 110.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -99.64 -34.09 4.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.565 -0.743 . . . . 1.23 110.972 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -74.55 -23.59 58.81 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.631 0.253 . . . . 1.35 111.242 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.04 29.4 34.31 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.77 -0.729 . . . . 1.25 112.743 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.632 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.4 p-10 -84.92 -20.3 30.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.901 0.381 . . . . 1.06 110.32 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.03 -7.9 59.04 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 121.031 -0.604 . . . . 0.9 112.943 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -128.26 163.71 24.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.392 0.615 . . . . 1.18 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.967 HG22 HD11 ' A' ' 125' ' ' ILE . 0.1 OUTLIER -99.73 101.15 11.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.188 -0.915 . . . . 1.08 108.826 178.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -86.34 171.61 11.06 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.768 -0.373 . . . . 0.84 110.579 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -51.71 -50.41 60.57 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.498 0.499 . . . . 1.45 111.957 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.67 -55.03 39.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.604 -0.271 . . . . 1.84 111.463 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.55 -43.45 97.21 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.816 0.341 . . . . 0.68 110.547 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -55.03 -54.26 45.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.603 -0.726 . . . . 0.85 111.178 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 89.9 t -70.16 -43.89 78.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 1.23 112.045 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -63.35 -44.0 96.09 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.333 0.494 . . . . 1.96 112.333 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.75 72.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.804 0.298 . . . . 0.89 111.804 -178.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.537 ' SD ' HD13 ' B' ' 296' ' ' LEU . 34.9 mtt -71.95 -47.7 50.46 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.993 0.368 . . . . 1.14 111.993 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 47.62 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.379 0.609 . . . . 1.53 110.527 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.59 130.27 41.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.424 -0.807 . . . . 1.64 110.268 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.188 -0.911 . . . . 3.35 109.843 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.854 0.359 . . . . 2.21 110.42 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.689 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -134.84 -10.29 2.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 1.57 111.168 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -56.39 -21.94 28.18 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 115.754 -0.657 . . . . 1.18 112.092 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.435 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 12.5 p-10 -92.0 -29.45 16.6 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.038 0.447 . . . . 1.07 111.315 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.567 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -72.21 -41.24 67.14 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-O 118.552 -0.737 . . . . 1.52 112.946 -177.685 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.647 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 66.0 m95 -57.73 -50.7 86.67 Favored Pre-proline 0 C--O 1.246 0.882 0 CA-C-N 119.546 1.066 . . . . 0.48 109.179 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 52.3 Cg_exo -58.34 -21.24 51.99 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.481 1.454 . . . . 0.61 111.735 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.57 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 69.4 m -57.63 -63.47 3.75 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-O 118.08 -0.962 . . . . 0.67 110.102 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.604 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 74.3 Cg_exo -55.72 -29.95 73.59 Favored 'Trans proline' 0 C--N 1.376 2.009 0 CA-C-N 121.815 1.684 . . . . 0.58 111.361 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.537 HD13 ' SD ' ' A' ' 145' ' ' MET . 5.1 tp -65.25 -44.18 88.97 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.328 0.585 . . . . 0.94 109.763 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 69.2 mtm -68.17 -31.23 70.63 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.235 -1.024 . . . . 1.48 108.235 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.495 HG12 ' O ' ' B' ' 294' ' ' SER . 38.1 mm -66.84 -28.94 44.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 N-CA-C 108.752 -0.833 . . . . 0.7 108.752 177.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -42.41 93.06 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.565 -0.902 . . . . 1.21 108.565 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -70.53 -35.76 73.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.632 -0.713 . . . . 2.51 109.507 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 13.6 m -67.52 -44.9 77.27 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.407 -0.59 . . . . 0.81 109.407 178.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 302' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' B' ' 298' ' ' ILE . 0.1 OUTLIER -64.22 -36.24 83.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.592 -0.731 . . . . 2.25 109.237 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 23.6 tttp -58.12 -44.31 87.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.644 -0.707 . . . . 1.76 109.462 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -68.59 -44.92 73.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.808 . . . . 1.62 109.982 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 1.68 110.538 179.358 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.655 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.645 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 120.619 0.247 . . . . 2.82 111.52 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 1.5 mp0 -61.73 -55.35 31.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.819 0.343 . . . . 2.61 110.846 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.2 -34.66 73.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 1.78 110.502 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.544 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -65.4 -46.73 89.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.989 -0.55 . . . . 1.33 110.829 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -59.09 -44.22 91.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.108 -0.496 . . . . 2.26 110.576 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.433 ' CD ' ' HZ1' ' B' ' 299' ' ' LYS . 1.0 OUTLIER -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.813 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.73 80.75 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.136 0.493 . . . . 1.0 109.982 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -62.02 -38.72 89.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.241 -0.89 . . . . 0.86 110.163 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -71.86 -27.8 63.12 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.79 -0.641 . . . . 1.84 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.8 t -83.13 -45.04 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.378 -0.373 . . . . 1.24 111.258 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -66.69 -32.64 74.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.3 -0.409 . . . . 1.06 110.994 -179.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.663 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 25.9 t0 -83.73 91.42 7.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.91 -0.774 . . . . 0.95 108.91 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -85.27 -33.28 22.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.831 -0.622 . . . . 1.28 112.116 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.634 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.8 OUTLIER -69.14 -29.27 67.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.678 -0.409 . . . . 1.36 110.293 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.86 28.28 26.62 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.011 -0.614 . . . . 1.02 114.267 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.467 HD21 ' HB2' ' A' ' 99' ' ' TYR . 20.0 p-10 -90.8 -8.22 50.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 117.729 0.764 . . . . 0.86 110.781 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.0 17.5 61.15 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.831 -0.699 . . . . 0.67 111.728 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HB2' HD21 ' A' ' 97' ' ' ASN . 98.6 m-85 -144.54 145.32 31.77 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.76 0.314 . . . . 1.29 110.346 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.606 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 38.1 mt -90.85 100.81 11.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.954 -0.566 . . . . 0.56 109.65 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -79.35 163.19 25.06 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 1.33 110.442 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.02 -43.01 81.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 0.75 110.093 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.08 91.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.871 -0.604 . . . . 0.89 110.839 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.5 mt-10 -69.46 -37.83 77.49 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.537 -0.756 . . . . 0.86 111.036 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.603 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.1 tp -72.92 -29.79 63.4 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.766 0.317 . . . . 0.54 110.4 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.475 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 31.0 mtm-85 -61.31 -32.68 72.54 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.013 0.435 . . . . 2.15 110.306 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -82.26 -6.45 59.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.495 0.664 . . . . 1.21 110.686 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 104' ' ' GLU . 85.6 t -92.54 -51.82 10.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.902 -0.59 . . . . 0.72 110.288 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.544 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -69.22 -16.91 63.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.756 -0.656 . . . . 1.6 112.151 -178.69 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.432 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 0.4 OUTLIER -72.1 -35.84 69.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.934 0.397 . . . . 1.67 109.969 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -76.54 -20.47 56.84 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.675 -0.693 . . . . 1.85 109.864 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.59 HD11 ' HB3' ' B' ' 294' ' ' SER . 59.3 tp -71.96 -10.75 60.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.219 -0.901 . . . . 1.23 110.508 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 92.62 -42.72 2.66 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.797 -0.716 . . . . 1.13 111.342 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.02 75.69 5.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 2.09 110.148 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 57.3 mttp -73.66 113.02 10.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.441 -0.8 . . . . 1.92 110.545 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.97 179.85 4.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.912 -0.586 . . . . 1.27 110.06 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.3 p -87.32 171.09 10.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.475 -0.33 . . . . 1.08 110.845 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.475 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 25.1 t0 -59.19 -42.39 90.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.327 -0.397 . . . . 1.99 111.443 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -42.4 99.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.751 0.31 . . . . 2.75 110.534 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -65.02 -37.79 88.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 1.14 110.326 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 124' ' ' MET . 61.9 t -69.47 -40.86 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.724 -0.473 . . . . 0.86 109.724 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.47 -40.03 94.93 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.502 -0.555 . . . . 1.38 109.502 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -64.78 -34.0 77.31 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 109.161 -0.681 . . . . 1.94 109.161 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.676 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 8.0 mtp -60.87 -45.92 92.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 0.66 110.006 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.827 HG23 HG13 ' A' ' 136' ' ' VAL . 0.4 OUTLIER -77.79 -19.78 13.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.593 -0.443 . . . . 0.85 109.832 179.14 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -68.99 -30.25 68.62 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.11 -1.07 . . . . 1.7 108.11 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -88.36 -11.19 46.96 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.422 -1.263 . . . . 1.55 109.206 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -109.23 1.27 20.12 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.594 -0.73 . . . . 0.66 112.11 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 26.0 t0 -115.17 129.06 56.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.633 -0.506 . . . . 0.8 109.633 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.93 -33.59 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.255 -0.43 . . . . 1.23 111.132 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.639 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.4 p-10 -69.96 -25.3 63.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.874 0.369 . . . . 1.35 111.11 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.49 64.84 1.32 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.467 -0.873 . . . . 1.25 111.795 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.632 ' OD2' 'CA ' ' A' 1001 ' ' ' CA' . 0.7 OUTLIER -131.45 -18.27 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.679 0.276 . . . . 1.06 110.793 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.47 -25.86 26.74 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.577 -0.82 . . . . 0.9 113.065 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -116.44 176.1 5.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 1.18 110.216 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.827 HG13 HG23 ' A' ' 125' ' ' ILE . 30.0 m -106.82 122.01 60.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 1.08 108.692 178.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.406 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 28.7 p30 -94.57 -177.99 4.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.426 -0.352 . . . . 0.84 110.17 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -55.92 -49.25 73.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.793 0.33 . . . . 1.45 111.694 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.73 -54.09 49.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.106 -0.497 . . . . 1.84 111.632 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.406 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 41.2 mt-10 -61.76 -39.69 92.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.341 -0.39 . . . . 0.68 111.758 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 11.3 t80 -56.39 -58.62 7.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.85 111.376 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 22.6 t -65.87 -37.06 79.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.224 -0.443 . . . . 1.23 111.366 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -62.54 -44.18 96.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 1.96 111.582 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -45.14 65.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.883 0.373 . . . . 0.89 110.796 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.47 ' CG ' HD22 ' B' ' 296' ' ' LEU . 0.2 OUTLIER -62.42 -39.3 92.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.098 -0.501 . . . . 1.14 111.659 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.57 37.52 2.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.104 0.478 . . . . 1.53 110.776 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.92 81.7 8.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.151 -0.477 . . . . 1.64 111.006 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.389 -0.815 . . . . 3.35 109.538 179.489 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.75 ' N ' HD22 ' B' ' 290' ' ' ASN . 63.0 mtp180 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.821 0.343 . . . . 2.21 110.591 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.676 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.96 -41.77 97.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 1.57 111.566 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -45.77 -41.83 11.32 Favored 'General case' 0 C--O 1.223 -0.335 0 O-C-N 123.966 0.791 . . . . 1.18 113.032 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.75 HD22 ' N ' ' B' ' 287' ' ' ARG . 3.7 p30 -90.73 -27.93 18.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.876 -0.33 . . . . 1.07 111.885 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' B' ' 294' ' ' SER . 2.5 tp -73.53 -44.85 56.65 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 113.004 0.742 . . . . 1.52 113.004 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.612 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 69.1 m95 -54.26 -53.66 56.58 Favored Pre-proline 0 CA--C 1.551 1.004 0 CA-C-N 119.534 1.061 . . . . 0.48 109.526 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 42.9 Cg_exo -61.35 -20.82 69.87 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 121.637 1.558 . . . . 0.61 112.428 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 43.4 m -55.97 -64.79 1.95 Allowed Pre-proline 0 CA--C 1.544 0.73 0 CA-C-O 118.381 -0.819 . . . . 0.67 110.375 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 46.0 Cg_exo -59.24 -31.23 94.83 Favored 'Trans proline' 0 C--N 1.37 1.689 0 CA-C-N 121.494 1.569 . . . . 0.58 111.234 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.1 tp -60.5 -46.39 90.29 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.186 0.517 . . . . 0.94 109.871 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 41.6 ttm -68.33 -31.82 71.49 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.361 -0.607 . . . . 1.48 109.361 178.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.583 HG12 ' O ' ' B' ' 294' ' ' SER . 43.4 mm -62.01 -34.97 65.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.856 -0.794 . . . . 0.7 108.856 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.433 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 2.6 tttp -66.39 -40.92 89.95 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.765 -0.652 . . . . 1.21 109.85 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -61.34 -42.62 98.98 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.886 -0.783 . . . . 2.51 108.886 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 301' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' B' ' 304' ' ' ASN . 6.4 m -70.55 -30.13 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.563 -0.744 . . . . 0.81 109.858 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 5.6 tptp -67.68 -33.75 75.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.172 -0.677 . . . . 2.25 109.172 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -65.81 -37.59 86.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.205 -1.035 . . . . 1.76 108.205 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 304' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' B' ' 301' ' ' SER . 22.6 t30 -63.86 -41.15 97.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.76 -1.109 . . . . 1.62 108.792 177.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.581 -0.736 . . . . 1.68 109.602 178.202 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.663 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.64 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 120.693 0.282 . . . . 2.82 111.198 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -55.2 -42.71 73.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.762 -0.654 . . . . 2.61 112.019 -178.637 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.47 -44.58 69.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.183 0.438 . . . . 1.78 112.183 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.632 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.4 mt -65.25 -41.43 91.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.993 0.425 . . . . 1.33 111.188 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -68.79 -43.79 74.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.055 -0.52 . . . . 2.26 110.827 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 mm-40 -70.79 -35.04 72.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.86 -0.609 . . . . 1.91 112.063 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.26 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.747 0.308 . . . . 1.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -59.19 -42.06 89.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.554 . . . . 0.86 110.377 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.06 -29.79 66.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.903 -0.59 . . . . 1.84 110.536 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.466 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 57.9 t -74.71 -41.09 47.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 1.24 110.438 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -71.89 -37.25 70.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.069 -0.514 . . . . 1.06 110.791 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.674 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 21.2 t0 -83.68 104.89 14.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.658 -0.497 . . . . 0.95 109.658 178.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 5.2 mptt -91.43 -39.29 12.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.089 -0.505 . . . . 1.28 111.224 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 1.1 p-10 -69.48 -20.61 63.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.17 -0.468 . . . . 1.36 110.807 -178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.79 68.81 1.54 Allowed Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.153 -0.546 . . . . 1.02 112.774 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 24.2 p-10 -137.05 -0.41 2.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.891 0.377 . . . . 0.86 110.513 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.97 22.0 72.65 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.656 -0.783 . . . . 0.67 111.73 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.506 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 57.6 m-85 -142.82 122.86 13.63 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.688 0.28 . . . . 1.29 110.773 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.734 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 60.2 mt -82.13 102.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.712 -0.847 . . . . 0.56 108.712 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.6 t -76.32 163.29 27.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.592 -0.522 . . . . 1.33 109.592 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.5 -39.05 75.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.996 0.427 . . . . 0.75 110.459 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.91 88.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.89 110.508 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.71 -32.52 72.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.819 -0.628 . . . . 0.86 110.692 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.732 HD22 HG12 ' A' ' 125' ' ' ILE . 10.4 tp -77.27 -34.93 55.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.263 -0.426 . . . . 0.54 110.11 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.449 ' HG2' HG21 ' A' ' 121' ' ' VAL . 19.0 mtm180 -60.01 -34.22 73.05 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.515 -0.55 . . . . 2.15 109.515 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.09 -28.12 68.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.44 -0.8 . . . . 1.21 109.674 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.5 -35.33 44.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.72 109.998 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -34.77 73.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.214 -0.448 . . . . 1.6 110.345 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.469 HG23 ' HE3' ' A' ' 115' ' ' LYS . 1.3 m -63.8 -36.73 84.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.903 -0.589 . . . . 1.67 110.886 179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -84.74 -27.34 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.145 0.498 . . . . 1.85 109.952 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.84 -27.98 67.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.69 -0.686 . . . . 1.23 109.979 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.03 -49.77 0.86 Allowed Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.801 -0.636 . . . . 1.13 111.685 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.48 100.16 8.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.068 0.461 . . . . 2.09 110.019 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.469 ' HE3' HG23 ' A' ' 110' ' ' THR . 62.0 mttp -82.88 82.49 8.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.737 -0.665 . . . . 1.92 109.816 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.1 mt -72.54 166.66 22.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.689 -0.687 . . . . 1.27 111.691 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.4 p -77.4 168.67 19.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 1.08 111.095 -179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.18 -37.14 74.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.12 -0.491 . . . . 1.99 111.199 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -68.36 -37.36 80.38 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.894 0.378 . . . . 2.75 110.412 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -71.68 -34.28 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.784 -0.45 . . . . 1.14 109.784 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.449 HG21 ' HG2' ' A' ' 106' ' ' ARG . 77.0 t -67.78 -36.8 77.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.409 -0.96 . . . . 0.86 108.409 177.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 12.6 t70 -63.51 -41.99 98.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.131 -0.94 . . . . 1.38 108.572 177.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -60.65 -37.01 80.1 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.811 -0.631 . . . . 1.94 109.468 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.734 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 9.3 mtp -56.72 -51.46 68.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.218 -0.901 . . . . 0.66 111.777 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.732 HG12 HD22 ' A' ' 105' ' ' LEU . 1.4 mt -85.45 -14.07 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 119.077 -1.049 . . . . 0.85 111.382 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 20.0 ttm180 -68.11 -25.26 65.22 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.824 -1.176 . . . . 1.7 107.824 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.429 ' HB3' ' HB3' ' B' ' 288' ' ' ALA . 4.7 tt0 -97.5 -5.44 35.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 113.898 -1.501 . . . . 1.55 109.605 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.48 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -101.85 -44.59 5.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.16 -0.473 . . . . 0.66 111.733 -178.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 28.6 t70 -76.59 132.38 39.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.083 0.468 . . . . 0.8 111.179 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 37.4 mt -130.29 -23.59 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.799 -0.637 . . . . 1.23 110.893 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.611 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.1 p-10 -77.03 -22.4 53.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.426 -0.352 . . . . 1.35 111.828 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 98.62 -0.21 58.01 Favored Glycine 0 C--O 1.236 0.28 0 C-N-CA 120.434 -0.889 . . . . 1.25 113.699 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.1 OUTLIER -70.49 -24.68 62.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.277 0.538 . . . . 1.06 110.078 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.73 -8.17 59.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.852 -0.689 . . . . 0.9 113.461 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -123.89 -179.63 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.557 0.694 . . . . 1.18 111.169 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.734 ' CG2' ' HB ' ' A' ' 100' ' ' ILE . 0.0 OUTLIER -102.89 96.61 4.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 114.644 -1.162 . . . . 1.08 109.165 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 27.7 p30 -88.71 176.01 7.27 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.48 -0.488 . . . . 0.84 109.933 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -52.85 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.627 0.603 . . . . 1.45 112.627 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 30.5 mp0 -62.59 -50.82 69.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.457 -0.338 . . . . 1.84 111.776 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 39.4 mt-10 -62.67 -41.97 99.37 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.913 0.387 . . . . 0.68 110.706 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.427 ' HE2' ' O ' ' A' ' 85' ' ' ILE . 75.4 t80 -56.03 -56.25 23.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.535 -0.757 . . . . 0.85 111.365 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.42 -38.28 81.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.083 -0.508 . . . . 1.23 111.447 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.6 -41.52 92.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 1.96 111.429 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -38.94 62.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.039 0.447 . . . . 0.89 110.913 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.601 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -67.46 -47.64 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.495 . . . . 1.14 110.901 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.64 48.68 1.02 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.226 0.536 . . . . 1.53 109.895 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.45 101.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.671 -0.695 . . . . 1.64 110.804 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.308 -0.853 . . . . 3.35 109.833 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.723 0.297 . . . . 2.21 110.23 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.734 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -114.96 -33.9 5.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.254 -0.43 . . . . 1.57 111.178 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.33 -30.37 4.84 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 123.914 0.759 . . . . 1.18 112.344 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.483 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 20.3 p-10 -92.79 -34.18 13.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.302 0.482 . . . . 1.07 112.302 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.484 ' O ' ' HD3' ' B' ' 295' ' ' PRO . 9.6 mp -68.79 -46.66 68.14 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-O 118.3 -0.857 . . . . 1.52 112.724 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.609 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 59.8 m95 -52.98 -50.9 79.33 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-N 119.738 1.153 . . . . 0.48 109.927 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -64.01 -17.48 59.95 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 121.631 1.554 . . . . 0.61 112.385 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.584 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 74.2 m -60.32 -61.52 7.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-O 118.547 -0.739 . . . . 0.67 110.289 178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.592 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -60.88 -27.47 84.85 Favored 'Trans proline' 0 C--N 1.37 1.673 0 CA-C-N 121.481 1.565 . . . . 0.58 110.19 176.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 85' ' ' ILE . 4.4 tp -59.49 -47.74 84.33 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.041 -0.725 . . . . 0.94 109.041 177.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 50.3 ttm -67.33 -32.44 73.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.753 -0.658 . . . . 1.48 109.265 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.56 HG12 ' O ' ' B' ' 294' ' ' SER . 45.2 mm -65.66 -31.46 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.63 -0.714 . . . . 0.7 109.108 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -38.0 87.68 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.977 -1.12 . . . . 1.21 107.977 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 300' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' B' ' 303' ' ' LYS . 0.4 OUTLIER -65.36 -35.94 82.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.244 -0.889 . . . . 2.51 108.733 177.341 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.4 m -69.83 -36.43 75.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.659 -0.867 . . . . 0.81 108.659 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.5 tptp -67.75 -31.34 71.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.902 -0.777 . . . . 2.25 108.902 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 303' ' ' LYS . . . . . 0.415 ' HB3' ' O ' ' B' ' 300' ' ' ARG . 17.9 tttp -63.52 -43.73 96.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.214 -0.903 . . . . 1.76 108.794 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -69.49 -37.36 77.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.374 -0.83 . . . . 1.62 109.137 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.711 -0.677 . . . . 1.68 109.403 178.06 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.674 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.624 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 121.093 0.473 . . . . 2.82 110.709 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -62.06 -29.94 70.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.674 . . . . 2.61 110.313 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -57.54 -47.66 81.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.417 -0.811 . . . . 1.78 110.516 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.0 mt -72.02 -32.43 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.99 -0.55 . . . . 1.33 110.672 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -65.3 -45.79 82.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.116 -0.493 . . . . 2.26 110.157 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 91' ' ' VAL . 3.3 tt0 -66.62 -38.21 86.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 1.91 109.818 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.39 82.08 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.002 -0.544 . . . . 1.0 110.41 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.81 -40.9 89.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.86 110.407 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -66.33 -36.62 83.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.869 -0.605 . . . . 1.84 110.737 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 87' ' ' GLU . 58.6 t -71.84 -36.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.175 -0.466 . . . . 1.24 110.472 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 108' ' ' VAL . 3.7 m-30 -66.44 -54.03 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.476 . . . . 1.06 110.052 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.658 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 23.4 t0 -83.89 96.68 8.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.95 110.014 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -90.65 -34.6 15.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.71 -0.677 . . . . 1.28 111.63 -178.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.671 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 1.1 p-10 -68.72 -25.64 64.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.839 0.352 . . . . 1.36 110.7 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.28 44.02 7.19 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.853 -0.689 . . . . 1.02 113.121 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.57 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 4.8 p-10 -97.1 -7.56 32.38 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.731 -0.47 . . . . 0.86 109.731 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.2 0.7 76.71 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.848 -0.614 . . . . 0.67 113.576 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' A' ' 97' ' ' ASN . 71.3 m-85 -141.09 155.33 46.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.88 0.371 . . . . 1.29 110.639 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.674 ' HB ' HG23 ' A' ' 136' ' ' VAL . 84.9 mt -83.67 100.48 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.89 -0.781 . . . . 0.56 108.89 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -72.51 155.45 40.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.432 -0.349 . . . . 1.33 110.426 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.57 -35.81 75.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.119 0.485 . . . . 0.75 110.229 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.18 -37.89 81.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.89 109.972 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.51 -30.41 61.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.664 -0.698 . . . . 0.86 110.142 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.719 HD22 HG12 ' A' ' 125' ' ' ILE . 18.8 tp -72.15 -40.64 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.859 -0.609 . . . . 0.54 109.954 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 1.042 ' HG2' HG11 ' A' ' 121' ' ' VAL . 20.3 mtm180 -57.61 -33.35 68.14 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.466 -0.334 . . . . 2.15 110.586 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.795 -0.639 . . . . 1.21 109.744 179.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 92' ' ' PHE . 16.0 t -70.43 -40.82 78.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.724 -0.671 . . . . 0.72 110.403 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.616 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -61.12 -46.95 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.939 -0.573 . . . . 1.6 111.049 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.7 p -70.57 -32.58 70.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.885 0.374 . . . . 1.67 111.157 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -71.03 -28.16 64.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.285 -0.416 . . . . 1.85 110.156 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 51.7 tp -64.69 -29.56 70.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.82 -0.627 . . . . 1.23 110.465 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 111.3 -41.72 2.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.854 -0.688 . . . . 1.13 111.701 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -74.07 100.49 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.28 0.562 . . . . 2.09 109.784 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -81.87 123.13 28.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.509 -0.768 . . . . 1.92 111.268 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.0 mt -118.45 162.56 18.14 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.727 -0.67 . . . . 1.27 109.698 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.412 ' O ' HG23 ' A' ' 121' ' ' VAL . 26.6 p -75.07 168.22 20.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.992 -0.373 . . . . 1.08 109.992 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.3 -36.5 75.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.947 0.403 . . . . 1.99 110.249 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.01 -45.03 83.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.712 -0.677 . . . . 2.75 110.155 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.75 -38.41 86.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 1.14 110.708 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 1.042 HG11 ' HG2' ' A' ' 106' ' ' ARG . 85.1 t -67.12 -40.89 86.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.481 -0.563 . . . . 0.86 109.481 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.553 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 21.3 t70 -64.5 -40.07 94.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.046 -0.724 . . . . 1.38 109.046 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.04 -35.24 74.68 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.563 -0.532 . . . . 1.94 109.563 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.61 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -55.86 -45.08 78.59 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 0.66 109.763 178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.994 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -81.05 -27.82 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.845 -0.616 . . . . 0.85 111.202 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 44.2 mtm-85 -68.92 -19.93 64.21 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.451 0.643 . . . . 1.7 109.663 178.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.17 -13.28 26.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.056 -0.975 . . . . 1.55 109.876 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.751 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -102.44 -35.82 8.64 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.736 -0.666 . . . . 0.66 111.572 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.647 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 27.0 t0 -83.47 104.87 13.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.936 0.398 . . . . 0.8 110.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.66 -32.4 3.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.854 -0.612 . . . . 1.23 111.303 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.626 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -74.8 -12.93 60.51 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 1.35 111.375 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 69.53 61.02 4.68 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.102 -0.57 . . . . 1.25 112.538 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.619 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.9 OUTLIER -118.46 -19.85 8.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.552 0.215 . . . . 1.06 110.669 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.27 -22.46 32.86 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.669 -0.777 . . . . 0.9 112.941 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -122.81 173.29 7.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 1.18 111.047 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.994 HG22 HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -101.02 109.83 26.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.531 -0.759 . . . . 1.08 109.233 179.497 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 24.4 p30 -89.69 174.13 7.91 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.399 -0.521 . . . . 0.84 110.152 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -55.36 -49.54 72.01 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.46 0.541 . . . . 1.45 112.46 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.92 -52.98 63.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.316 -0.402 . . . . 1.84 111.863 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.402 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 45.3 mt-10 -61.57 -37.14 82.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.68 110.624 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -56.55 -54.83 41.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.85 110.797 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.7 t -70.23 -41.36 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.798 -0.637 . . . . 1.23 111.423 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -58.34 -52.29 66.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 1.96 112.156 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.431 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -66.38 -44.2 83.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.268 -0.424 . . . . 0.89 112.028 -178.122 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.453 ' HE2' ' O ' ' B' ' 292' ' ' TRP . 36.4 mtt -69.1 -45.16 70.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.829 0.347 . . . . 1.14 111.702 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 63.14 2.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.026 0.441 . . . . 1.53 110.214 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -94.99 157.16 16.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.91 -0.586 . . . . 1.64 111.326 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.301 -0.857 . . . . 3.35 109.169 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.363 -0.606 . . . . 2.21 109.363 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.61 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -116.55 0.72 12.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.859 -0.61 . . . . 1.57 111.829 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -39.39 -29.88 0.06 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.645 0.98 . . . . 1.18 113.645 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.484 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 9.0 p-10 -83.66 -21.69 32.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 117.607 0.185 . . . . 1.07 111.305 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.825 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 2.1 mp -71.5 -40.02 70.43 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-O 118.999 -0.524 . . . . 1.52 111.343 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.656 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 64.1 m95 -56.4 -51.68 79.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 119.235 -0.986 . . . . 0.48 108.8 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 51.2 Cg_exo -60.15 -19.71 58.07 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.59 1.527 . . . . 0.61 112.354 176.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.531 ' O ' HG12 ' B' ' 298' ' ' ILE . 49.6 m -57.08 -63.66 3.41 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.802 -0.618 . . . . 0.67 110.29 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.825 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 11.2 Cg_endo -58.78 -29.61 90.29 Favored 'Trans proline' 0 C--N 1.369 1.61 0 CA-C-N 120.915 1.363 . . . . 0.58 110.94 176.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.442 HD13 ' SD ' ' A' ' 145' ' ' MET . 8.3 tp -64.57 -39.01 92.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.098 -0.705 . . . . 0.94 109.098 177.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 38.4 ttm -70.63 -32.81 70.27 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.655 -0.869 . . . . 1.48 108.655 178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.531 HG12 ' O ' ' B' ' 294' ' ' SER . 49.0 mm -65.42 -29.88 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 108.502 -0.925 . . . . 0.7 108.502 177.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -39.36 82.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.515 -0.921 . . . . 1.21 108.515 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -64.66 -39.81 94.33 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.58 -0.896 . . . . 2.51 108.58 177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 8.8 m -69.19 -36.35 77.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.14 -0.936 . . . . 0.81 109.468 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -64.53 -37.08 86.3 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.24 -0.652 . . . . 2.25 109.24 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -62.18 -43.61 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.833 -0.621 . . . . 1.76 109.356 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -68.12 -43.32 78.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.592 -0.731 . . . . 1.62 109.454 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.626 . . . . 1.68 109.988 179.509 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.671 'CA ' ' OD1' ' A' ' 95' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.647 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.628 0.251 . . . . 2.82 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 1.6 mp0 -57.54 -40.84 79.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 2.61 110.909 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.413 ' OE2' ' HE2' ' B' ' 299' ' ' LYS . 0.5 OUTLIER -60.62 -35.89 77.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 1.78 110.452 179.293 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.579 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.1 mt -71.98 -40.96 68.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.71 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG3' ' OH ' ' A' ' 138' ' ' TYR . 42.9 ttt-85 -65.71 -47.74 74.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.304 -0.407 . . . . 2.26 110.449 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 91' ' ' VAL . 21.7 mm-40 -68.43 -26.85 65.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 1.91 110.814 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.05 -38.62 89.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.114 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -59.62 -39.36 84.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.86 109.945 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -67.34 -38.88 85.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.894 -0.594 . . . . 1.84 110.185 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 87' ' ' GLU . 61.4 t -70.9 -35.58 60.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 1.24 110.484 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -69.13 -49.96 52.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.943 -0.571 . . . . 1.06 109.958 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.662 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 22.3 t0 -81.6 74.48 8.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.95 109.741 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -66.97 -28.81 68.57 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.28 111.763 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.621 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.0 OUTLIER -74.8 -31.32 61.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.825 0.345 . . . . 1.36 110.471 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.53 60.55 2.62 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.895 -0.669 . . . . 1.02 113.23 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 7.6 p-10 -122.99 -7.02 8.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.86 110.097 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.11 10.53 68.76 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.742 -0.663 . . . . 0.67 112.965 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -142.51 129.59 20.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.883 0.373 . . . . 1.29 111.221 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.62 ' HB ' HG22 ' A' ' 136' ' ' VAL . 54.9 mt -79.68 103.04 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.941 -0.763 . . . . 0.56 108.941 178.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 43.9 t -82.0 160.62 23.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.829 -0.623 . . . . 1.33 110.255 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.5 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.01 -39.09 80.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 0.75 110.304 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.37 -35.58 81.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.89 110.558 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.35 -36.96 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.976 -0.556 . . . . 0.86 110.055 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.556 HD22 ' CG1' ' A' ' 125' ' ' ILE . 12.4 tp -66.94 -34.5 77.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.254 0.549 . . . . 0.54 109.562 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 16.1 mtm180 -70.22 -15.69 62.96 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.879 -0.6 . . . . 2.15 110.198 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.92 4.3 52.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.321 0.581 . . . . 1.21 110.13 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.2 t -114.14 -49.44 5.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.41 -0.814 . . . . 0.72 109.276 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -8.42 51.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.883 . . . . 1.6 111.826 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.458 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -72.53 -41.55 65.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.366 0.603 . . . . 1.67 109.63 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -78.12 -14.56 59.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.415 -0.812 . . . . 1.85 109.919 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 294' ' ' SER . 9.4 tt -63.54 -32.62 74.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 1.23 110.135 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.57 -62.57 0.29 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.242 -0.743 . . . . 1.13 111.242 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.53 82.31 4.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.243 0.544 . . . . 2.09 110.161 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 110' ' ' THR . 34.8 mttp -81.73 111.16 17.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.713 -0.676 . . . . 1.92 110.214 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 HD22 ' B' ' 291' ' ' LEU . 0.1 OUTLIER -85.33 175.25 9.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.334 -0.394 . . . . 1.27 110.816 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.481 ' O ' HG23 ' A' ' 121' ' ' VAL . 37.0 p -73.61 163.62 27.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.386 -0.37 . . . . 1.08 110.903 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -61.48 -31.41 71.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.956 0.408 . . . . 1.99 110.211 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -64.31 -40.26 95.56 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.48 0.657 . . . . 2.75 109.404 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 116' ' ' LEU . 46.6 mt-10 -74.44 -33.19 62.87 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.328 -0.851 . . . . 1.14 110.223 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 117' ' ' THR . 81.8 t -61.43 -40.23 85.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 108.225 -1.028 . . . . 0.86 108.225 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.23 -45.0 95.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.653 -1.158 . . . . 1.38 109.531 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.61 -38.32 90.59 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.0 -0.546 . . . . 1.94 110.204 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.607 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 6.5 mtp -59.5 -48.0 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.66 111.136 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.635 HD13 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -73.97 -35.27 41.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 C-N-CA 120.539 -0.465 . . . . 0.85 110.414 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 126' ' ' ARG . 28.5 mtm180 -64.62 -34.05 77.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.051 0.453 . . . . 1.7 110.018 178.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -73.45 -17.78 61.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.485 0.66 . . . . 1.55 109.417 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB3' HG11 ' A' ' 136' ' ' VAL . . . -108.17 8.69 28.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.378 -0.828 . . . . 0.66 110.21 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.646 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 27.3 t0 -117.17 116.03 26.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.049 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.53 -29.45 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.155 -0.475 . . . . 1.23 110.734 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.617 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -77.22 -15.24 59.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 1.35 110.64 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.45 60.66 4.58 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.239 -0.505 . . . . 1.25 112.819 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.534 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.6 OUTLIER -123.66 -17.08 6.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.586 0.231 . . . . 1.06 111.468 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.05 -3.79 55.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.371 -0.918 . . . . 0.9 113.065 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -136.41 161.45 35.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.696 -0.483 . . . . 1.18 109.696 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.635 HG13 HD13 ' A' ' 125' ' ' ILE . 3.2 m -106.81 115.46 48.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 108.865 -0.791 . . . . 1.08 108.865 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.595 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.2 p30 -88.54 -176.22 5.22 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.851 -0.425 . . . . 0.84 109.851 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.405 ' OH ' ' HG3' ' A' ' 86' ' ' ARG . 18.7 t80 -59.34 -45.88 90.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.755 0.312 . . . . 1.45 111.746 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.28 -42.03 99.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.279 -0.419 . . . . 1.84 111.249 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.595 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 26.4 mt-10 -73.34 -32.17 64.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.68 110.132 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.83 -56.94 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.244 -0.889 . . . . 0.85 110.851 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.55 -33.01 55.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 115.851 -0.613 . . . . 1.23 110.807 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -38.69 90.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 1.96 111.1 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -43.37 26.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.305 -0.407 . . . . 0.89 111.421 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.488 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -66.24 -49.37 67.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.255 -0.429 . . . . 1.14 111.903 -179.178 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.32 31.14 2.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.67 121.14 10.88 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.861 -0.609 . . . . 1.64 111.448 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.497 -0.763 . . . . 3.35 109.569 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 287' ' ' ARG . . . . . 0.691 ' N ' HD22 ' B' ' 290' ' ' ASN . 52.9 mtp180 . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.799 0.333 . . . . 2.21 110.531 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 288' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.26 -47.36 82.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 1.57 111.345 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -44.36 -45.1 8.68 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 113.363 0.875 . . . . 1.18 113.363 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 290' ' ' ASN . . . . . 0.691 HD22 ' N ' ' B' ' 287' ' ' ARG . 5.1 p30 -90.72 -26.99 19.25 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.55 0.574 . . . . 1.07 112.55 -179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 291' ' ' LEU . . . . . 0.531 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -68.93 -45.12 71.61 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 120.172 -0.611 . . . . 1.52 112.624 -178.449 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 292' ' ' TRP . . . . . 0.661 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 89.5 m95 -54.68 -51.5 78.17 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 118.809 0.731 . . . . 0.48 109.739 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 36.0 Cg_exo -62.57 -18.35 63.19 Favored 'Trans proline' 0 C--N 1.363 1.321 0 C-N-CA 121.506 1.471 . . . . 0.61 112.326 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 294' ' ' SER . . . . . 0.603 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 61.6 m -58.74 -60.85 9.08 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 118.374 -0.822 . . . . 0.67 110.414 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 295' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 35.2 Cg_exo -60.94 -29.7 88.54 Favored 'Trans proline' 0 C--N 1.373 1.829 0 CA-C-N 121.359 1.521 . . . . 0.58 110.562 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 85' ' ' ILE . 7.0 tp -61.14 -44.18 97.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.095 -0.706 . . . . 0.94 109.095 177.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 30.8 ttm -64.91 -35.91 82.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.373 -0.83 . . . . 1.48 109.072 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 298' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 294' ' ' SER . 39.7 mm -61.72 -33.38 57.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.652 -0.703 . . . . 0.7 109.476 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 299' ' ' LYS . . . . . 0.413 ' HE2' ' OE2' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -64.65 -40.29 95.19 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 108.777 -0.823 . . . . 1.21 108.777 178.317 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.8 -44.69 84.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.482 -0.781 . . . . 2.51 109.34 178.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 18.2 m -64.41 -36.31 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.973 -0.558 . . . . 0.81 109.738 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -66.18 -33.38 75.62 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.901 -0.777 . . . . 2.25 108.901 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -69.26 -32.13 71.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 1.76 109.217 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -72.83 -46.09 54.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.472 -0.786 . . . . 1.62 110.009 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 116.396 -0.365 . . . . 1.68 110.029 179.37 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1000 ' ' ' CA' . . . . . 0.662 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1001 ' ' ' CA' . . . . . 0.646 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 120.712 0.291 . . . . 2.61 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -33.72 72.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 1.78 111.481 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.475 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.6 mt -68.21 -43.09 85.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.013 0.435 . . . . 1.33 110.319 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -64.91 -47.63 77.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.661 -0.7 . . . . 2.26 110.488 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -68.73 -30.01 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.916 -0.583 . . . . 1.91 110.882 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.34 82.62 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.479 -0.328 . . . . 1.0 110.676 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.5 -38.96 75.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.034 0.445 . . . . 0.86 110.329 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -70.73 -35.5 72.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.911 -0.586 . . . . 1.84 110.526 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.463 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 98.2 t -72.49 -35.18 50.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.092 -0.504 . . . . 1.24 110.76 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -73.45 -39.05 65.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 1.06 110.09 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.7 103.87 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.646 -0.706 . . . . 0.95 110.776 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 2.5 mptt -94.63 -28.66 15.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.443 -0.344 . . . . 1.28 111.563 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.423 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -77.32 -21.81 52.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.841 0.353 . . . . 1.36 111.028 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.7 57.55 4.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.032 -0.604 . . . . 1.02 113.391 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 19.8 p-10 -125.88 -1.11 7.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.046 0.451 . . . . 0.86 110.413 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.94 23.96 73.26 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.946 -0.645 . . . . 0.67 112.231 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.44 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 42.2 m-85 -142.8 139.46 30.97 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.188 0.518 . . . . 1.29 111.102 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 105' ' ' LEU . 66.7 mt -93.03 99.34 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.113 -0.949 . . . . 0.56 109.705 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.2 t -81.9 163.87 21.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.899 -0.592 . . . . 1.33 110.126 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.38 90.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.75 110.818 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -32.88 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.89 110.993 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -74.49 -41.18 61.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.436 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.66 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.9 tp -65.52 -29.91 70.61 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.392 -0.367 . . . . 0.54 110.124 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -57.0 -56.34 23.06 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.149 -0.478 . . . . 2.15 110.107 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -58.08 -35.55 71.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.864 0.364 . . . . 1.21 111.472 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.77 -56.97 10.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.3 -0.409 . . . . 0.72 111.743 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.566 ' CE ' ' HA ' ' B' ' 292' ' ' TRP . 0.8 OUTLIER -72.5 -19.73 61.48 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.114 0.783 . . . . 1.6 113.114 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.7 p -78.64 -41.79 30.52 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.122 -0.631 . . . . 1.67 110.551 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -67.33 -23.11 65.59 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.378 0.609 . . . . 1.85 109.944 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.51 -35.51 74.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.019 -0.991 . . . . 1.23 110.337 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.01 -65.38 0.56 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.667 -0.778 . . . . 1.13 112.211 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -74.9 90.19 2.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.14 0.495 . . . . 2.09 110.75 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -83.02 104.97 13.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 1.92 110.681 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 83.3 mt -91.71 175.4 6.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.11 -0.495 . . . . 1.27 110.23 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 121' ' ' VAL . 40.6 p -76.5 166.34 23.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.703 0.287 . . . . 1.08 111.368 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.46 -37.87 70.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 1.99 110.685 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.28 -44.17 95.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.048 -0.524 . . . . 2.75 110.575 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 124' ' ' MET . 37.8 mt-10 -67.9 -37.31 81.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 1.14 110.336 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.463 ' O ' ' HB2' ' A' ' 124' ' ' MET . 97.6 t -64.98 -41.45 92.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 N-CA-C 109.04 -0.726 . . . . 0.86 109.04 177.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.4 t70 -65.69 -44.26 86.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.87 -0.789 . . . . 1.38 108.87 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 127' ' ' GLU . 19.9 tt0 -53.01 -41.58 64.78 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.446 -0.797 . . . . 1.94 109.704 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.623 ' HG2' ' HB3' ' B' ' 288' ' ' ALA . 57.3 mtp -54.47 -51.0 66.41 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.07 -0.968 . . . . 0.66 110.852 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.852 HG23 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -76.49 -22.49 15.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.251 -0.58 . . . . 0.85 111.002 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 59.3 mtm-85 -65.33 -37.08 85.99 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.35 -0.611 . . . . 1.7 109.35 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' B' ' 289' ' ' ALA . 12.8 pt-20 -92.41 -1.99 56.63 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 1.55 109.988 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.599 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -107.55 5.38 26.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.511 0.672 . . . . 0.66 109.682 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.66 125.51 52.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.11 -0.95 . . . . 0.8 109.708 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.72 -27.12 2.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.186 -0.461 . . . . 1.23 110.791 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.52 -10.34 59.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.282 -0.417 . . . . 1.35 111.072 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.48 62.51 3.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.745 -0.74 . . . . 1.25 112.426 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -135.1 -17.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.649 0.261 . . . . 1.06 110.81 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.93 -14.92 63.97 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.901 -0.666 . . . . 0.9 113.298 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -119.26 169.21 10.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 1.18 110.632 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.852 HG13 HG23 ' A' ' 125' ' ' ILE . 27.0 m -106.09 113.7 43.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.142 0.496 . . . . 1.08 109.87 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.509 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 25.4 p30 -92.21 -177.63 4.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.349 -0.612 . . . . 0.84 109.349 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.92 -57.04 12.45 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.986 0.365 . . . . 1.45 111.986 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -57.45 -46.95 83.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 1.84 111.766 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.509 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 32.7 mt-10 -61.79 -42.92 99.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.795 0.331 . . . . 0.68 110.511 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.15 -45.39 91.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.774 -0.648 . . . . 0.85 110.114 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 70.3 t -64.29 -49.94 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.427 -0.806 . . . . 1.23 111.689 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.69 -38.6 87.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.437 0.532 . . . . 1.96 112.437 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.449 ' HE3' ' HB2' ' A' ' 128' ' ' ALA . 0.1 OUTLIER -70.4 -41.69 72.65 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.746 -0.382 . . . . 0.89 111.589 -179.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.513 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -74.99 -45.92 38.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.016 0.436 . . . . 1.14 111.006 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.43 77.88 1.68 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.205 -0.452 . . . . 1.53 110.749 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -91.72 126.77 36.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.123 -0.49 . . . . 1.64 110.721 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.24 -0.886 . . . . 3.35 109.784 179.775 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 109.072 -0.714 . . . . 2.21 109.072 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.623 ' HB3' ' HG2' ' A' ' 124' ' ' MET . . . -97.77 0.68 47.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.55 -0.75 . . . . 1.57 112.763 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . 0.532 ' HB2' ' OE1' ' A' ' 127' ' ' GLU . . . -32.23 -50.29 0.22 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.328 0.862 . . . . 1.18 113.328 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.529 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.9 p-10 -59.94 -24.29 64.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.64 0.257 . . . . 1.07 111.437 -179.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.589 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.3 tp -69.52 -25.17 63.9 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 109.332 -0.618 . . . . 1.52 109.332 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.644 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 53.5 m95 -60.88 -56.96 29.93 Favored Pre-proline 0 C--O 1.249 1.045 0 N-CA-C 106.976 -1.49 . . . . 0.48 106.976 176.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 50.2 Cg_exo -59.17 -17.85 41.08 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 121.268 1.312 . . . . 0.61 112.276 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 43.4 m -56.7 -64.73 2.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-O 118.288 -0.863 . . . . 0.67 110.923 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 31.4 Cg_exo -62.24 -26.49 77.53 Favored 'Trans proline' 0 C--N 1.372 1.79 0 CA-C-N 121.889 1.71 . . . . 0.58 110.62 176.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.8 tp -62.12 -44.42 96.67 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.583 0.706 . . . . 0.94 109.158 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 34.1 ttm -67.45 -32.88 74.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 1.48 108.923 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.52 HG12 ' O ' ' B' ' 294' ' ' SER . 40.7 mm -65.55 -32.48 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.211 -0.904 . . . . 0.7 109.191 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -45.18 94.46 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.89 -0.781 . . . . 1.21 108.89 177.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -66.68 -35.22 79.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.828 -0.624 . . . . 2.51 109.604 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 49.0 m -69.42 -36.74 76.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.81 109.736 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -66.98 -31.22 71.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 2.25 109.42 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -66.43 -42.48 87.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.691 -0.855 . . . . 1.76 108.691 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.43 -41.43 84.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.306 -0.861 . . . . 1.62 109.207 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 1.68 109.53 178.656 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 CA--C 1.527 0.092 0 N-CA-C 112.659 0.614 . . . . 2.61 112.659 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -63.14 -28.29 69.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 111.787 0.291 . . . . 1.78 111.787 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' B' ' 296' ' ' LEU . 0.9 OUTLIER -64.94 -48.0 85.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.23 0.538 . . . . 1.33 109.667 179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -70.6 -44.53 67.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.568 -0.742 . . . . 2.26 110.121 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 91' ' ' VAL . 42.1 mm-40 -61.02 -43.1 99.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.827 -0.624 . . . . 1.91 111.173 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.99 79.5 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.119 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -56.81 -41.37 77.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.627 -0.715 . . . . 0.86 110.64 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -68.13 -36.22 79.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.834 -0.621 . . . . 1.84 111.571 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.543 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 94.3 t -77.88 -35.83 21.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.821 0.343 . . . . 1.24 111.016 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -71.42 -33.14 69.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.504 -0.316 . . . . 1.06 110.813 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -82.9 90.01 6.91 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.607 -0.516 . . . . 0.95 109.607 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 4.6 mptt -91.64 -18.9 23.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 1.28 111.714 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.434 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER -79.46 -23.92 42.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.874 -0.33 . . . . 1.36 110.549 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.5 58.1 3.69 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.845 -0.693 . . . . 1.02 113.127 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.434 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 19.9 p-10 -126.67 -5.62 6.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.867 0.365 . . . . 0.86 110.295 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.96 17.15 77.67 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.847 -0.615 . . . . 0.67 112.751 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -143.89 139.11 29.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.703 0.287 . . . . 1.29 110.577 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.572 ' HB ' HG22 ' A' ' 136' ' ' VAL . 9.8 mt -84.76 103.12 11.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.541 -0.911 . . . . 0.56 108.541 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.506 ' HA ' ' HG2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -82.58 164.02 21.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.655 -0.702 . . . . 1.33 110.367 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -56.46 -44.41 80.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.75 111.044 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -41.33 96.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.045 0.45 . . . . 0.89 110.739 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 108' ' ' VAL . 47.7 mt-10 -67.49 -41.77 83.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.745 -0.662 . . . . 0.86 110.469 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.498 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 16.3 tp -67.31 -32.33 73.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.287 -0.415 . . . . 0.54 110.245 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.493 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 30.3 mtm-85 -57.97 -39.44 78.16 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.638 -0.504 . . . . 2.15 109.638 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -71.31 -33.48 69.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.519 . . . . 1.21 110.106 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 104' ' ' GLU . 96.0 t -62.15 -49.15 85.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.09 -0.505 . . . . 0.72 110.07 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.498 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.2 OUTLIER -66.26 -34.0 77.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 1.6 110.683 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.2 m -64.19 -45.72 87.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.912 0.386 . . . . 1.67 110.22 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -73.98 -24.25 59.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 1.85 110.26 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' B' ' 294' ' ' SER . 17.8 tp -63.69 -31.77 73.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.673 -0.694 . . . . 1.23 110.302 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.01 -40.17 2.61 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.786 -0.721 . . . . 1.13 112.071 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.68 98.0 5.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 2.09 110.474 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -89.14 100.52 13.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 1.92 110.337 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.84 -174.29 2.5 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.818 -0.628 . . . . 1.27 110.824 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 43.8 p -78.19 165.17 24.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 1.08 110.722 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.493 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 18.9 t70 -63.79 -37.63 88.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.326 -0.397 . . . . 1.99 110.737 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -66.0 -31.85 72.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.134 -0.484 . . . . 2.75 110.386 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -67.38 -37.95 83.95 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.157 -0.683 . . . . 1.14 109.157 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' A' ' 124' ' ' MET . 58.6 t -67.72 -36.33 75.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.638 -0.875 . . . . 0.86 108.638 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -65.87 -43.3 88.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.197 -0.91 . . . . 1.38 108.896 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -57.7 -38.84 75.89 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.802 -0.814 . . . . 1.94 108.802 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.692 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 38.8 mtp -58.18 -52.27 66.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.177 -0.92 . . . . 0.66 111.276 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.655 HD13 HG13 ' A' ' 136' ' ' VAL . 1.5 mm -68.67 -34.86 67.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 120.753 -0.379 . . . . 0.85 110.485 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -64.38 -29.65 70.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.947 0.403 . . . . 1.7 110.121 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.52 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 4.5 tt0 -86.14 -27.08 24.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.531 -0.759 . . . . 1.55 110.664 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -89.31 -26.12 21.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.061 -0.518 . . . . 0.66 112.027 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -90.59 109.71 20.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.981 0.419 . . . . 0.8 109.967 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 6.1 mt -100.68 -31.43 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.875 -0.602 . . . . 1.23 111.134 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.56 -20.16 58.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.773 0.321 . . . . 1.35 111.447 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.84 61.87 2.33 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.666 -0.778 . . . . 1.25 113.005 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -121.72 -14.11 8.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.858 0.361 . . . . 1.06 110.269 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.67 -11.41 61.11 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.076 -0.583 . . . . 0.9 112.632 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 101' ' ' SER . 16.5 mt-30 -132.29 165.35 24.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.329 0.585 . . . . 1.18 110.853 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.655 HG13 HD13 ' A' ' 125' ' ' ILE . 4.6 m -106.8 124.9 62.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.79 -0.819 . . . . 1.08 108.79 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.557 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.8 p30 -103.54 -178.46 3.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.442 -0.345 . . . . 0.84 110.348 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 142' ' ' VAL . 68.9 t80 -59.2 -44.18 92.23 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 111.914 0.339 . . . . 1.45 111.914 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -61.97 -46.08 90.85 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.698 0.285 . . . . 1.84 111.524 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.557 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 31.7 mt-10 -72.29 -32.24 66.43 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.123 0.487 . . . . 0.68 110.384 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 10.3 t80 -58.89 -52.73 64.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.351 -0.84 . . . . 0.85 111.56 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 138' ' ' TYR . 44.7 t -60.82 -36.48 71.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.488 . . . . 1.23 111.463 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.0 -25.76 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.41 . . . . 1.96 111.912 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.52 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -73.15 -56.46 5.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.075 0.464 . . . . 0.89 110.901 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.555 ' HG2' HD22 ' B' ' 296' ' ' LEU . 2.0 mpt? -68.46 -53.29 24.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.814 -0.63 . . . . 1.14 111.244 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 73.77 10.02 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.931 0.396 . . . . 1.53 110.956 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 65.98 6.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 1.64 110.908 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 41.0 mmtt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.697 -0.668 . . . . 3.35 110.287 -179.971 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.572 ' HA ' ' CZ ' ' B' ' 287' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 109.906 -0.405 . . . . 2.21 109.906 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.692 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -111.17 -28.76 8.14 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.861 0.689 . . . . 1.57 112.861 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.39 -33.95 9.99 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 1.18 112.54 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 21.5 p-10 -92.1 -30.68 15.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 111.967 0.358 . . . . 1.07 111.967 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.782 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 6.1 tp -72.79 -41.71 64.71 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 113.426 0.899 . . . . 1.52 113.426 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' A' ' 136' ' ' VAL . 77.0 m95 -56.61 -50.87 85.36 Favored Pre-proline 0 C--O 1.247 0.954 0 CA-C-N 119.918 1.236 . . . . 0.48 108.989 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 44.6 Cg_exo -60.53 -21.71 69.44 Favored 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 121.591 1.527 . . . . 0.61 111.877 176.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 66.6 m -55.84 -65.27 1.6 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-O 118.523 -0.751 . . . . 0.67 110.809 179.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.782 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 13.5 Cg_endo -60.02 -31.21 93.17 Favored 'Trans proline' 0 C--N 1.368 1.589 0 CA-C-N 121.345 1.516 . . . . 0.58 111.665 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.602 HD11 ' HA ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -64.79 -44.79 88.8 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.004 -0.678 . . . . 0.94 109.926 178.47 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 43.4 ttm -69.39 -35.37 75.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.115 -0.698 . . . . 1.48 109.115 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' B' ' 295' ' ' PRO . 22.8 mm -65.62 -30.49 50.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.333 -0.849 . . . . 0.7 109.118 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -68.08 -39.03 82.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.076 -0.713 . . . . 1.21 109.076 178.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -65.17 -36.63 84.81 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.264 -1.013 . . . . 2.51 108.264 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 10.9 m -71.55 -32.63 68.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.013 -0.994 . . . . 0.81 109.291 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -69.2 -38.62 78.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.464 -0.939 . . . . 2.25 108.464 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -60.27 -42.43 95.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.307 -0.998 . . . . 1.76 108.307 177.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -62.54 -41.22 98.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.922 -1.035 . . . . 1.62 109.086 177.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.292 -0.867 . . . . 1.68 110.263 179.405 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.082 0 CA-C-O 120.505 0.193 . . . . 2.61 111.495 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.46 -31.86 68.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.531 -0.304 . . . . 1.78 111.548 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.559 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.1 mt -66.36 -42.7 91.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.923 0.392 . . . . 1.33 110.479 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -65.1 -41.09 95.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.395 0.617 . . . . 2.26 109.433 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -68.02 -39.85 83.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.691 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.44 -41.84 77.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.024 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -57.77 -38.76 75.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.072 -0.513 . . . . 0.86 110.818 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -74.71 -40.02 61.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.183 -0.462 . . . . 1.84 111.006 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.25 -36.94 78.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 1.24 111.052 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -73.72 -40.03 63.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.41 . . . . 1.06 110.192 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.516 ' HA ' ' OE2' ' A' ' 104' ' ' GLU . 31.0 t70 -81.98 75.55 8.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.415 0.626 . . . . 0.95 110.175 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -77.74 -21.62 51.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.394 -0.821 . . . . 1.28 111.225 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.405 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.1 OUTLIER -77.97 -13.05 60.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.566 -0.288 . . . . 1.36 110.786 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 63.5 63.95 4.1 Favored Glycine 0 C--N 1.333 0.363 0 CA-C-N 115.925 -0.579 . . . . 1.02 112.962 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 99' ' ' TYR . 0.4 OUTLIER -132.57 -8.62 3.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.871 0.367 . . . . 0.86 110.528 -179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.71 15.75 74.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.14 -0.552 . . . . 0.67 113.937 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.595 ' HB2' HD21 ' A' ' 97' ' ' ASN . 94.5 m-85 -144.76 133.62 22.45 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.422 0.611 . . . . 1.29 110.929 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.474 HG21 HD13 ' A' ' 105' ' ' LEU . 33.6 mt -81.99 112.58 20.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.839 -0.618 . . . . 0.56 109.62 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.5 p -95.67 172.97 7.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 1.33 110.166 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.88 92.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.659 0.266 . . . . 0.75 110.298 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.03 76.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.89 111.092 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.516 ' OE2' ' HA ' ' A' ' 93' ' ' ASP . 49.1 mt-10 -63.01 -36.83 84.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.987 -0.551 . . . . 0.86 111.166 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.571 HD22 ' CD1' ' A' ' 125' ' ' ILE . 7.0 tp -76.73 -34.54 58.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.643 -0.253 . . . . 0.54 111.02 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.413 ' NE ' HG11 ' A' ' 121' ' ' VAL . 36.1 mtt180 -58.81 -37.31 76.12 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.705 -0.48 . . . . 2.15 109.705 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.0 -23.05 65.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.493 -0.776 . . . . 1.21 110.62 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.6 t -83.04 -47.35 18.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.929 -0.578 . . . . 0.72 110.564 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.6 mmt -66.27 -30.42 70.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.81 -0.632 . . . . 1.6 112.091 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -41.5 86.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.043 0.449 . . . . 1.67 110.247 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.77 -27.76 62.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.763 -0.653 . . . . 1.85 109.555 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.4 tp -63.3 -39.49 94.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.309 -0.859 . . . . 1.23 109.703 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.88 -31.16 4.85 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.63 -0.714 . . . . 1.13 111.608 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.0 93.07 7.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.373 0.606 . . . . 2.09 110.695 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -87.86 95.83 10.25 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.516 -0.766 . . . . 1.92 109.336 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.92 163.57 17.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.964 -0.562 . . . . 1.27 111.148 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.7 p -81.24 169.35 17.43 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.836 -0.62 . . . . 1.08 110.05 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -36.03 70.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.875 0.369 . . . . 1.99 110.969 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.0 -46.72 76.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 2.75 110.421 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.03 -37.36 83.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.891 -0.595 . . . . 1.14 110.636 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 117' ' ' THR . 69.6 t -63.23 -32.25 55.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.954 0.407 . . . . 0.86 110.0 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.5 -53.0 61.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.028 -0.533 . . . . 1.38 109.784 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 126' ' ' ARG . 19.6 tt0 -67.75 -26.79 66.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.091 -0.504 . . . . 1.94 110.059 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.758 ' HE3' ' HB3' ' B' ' 291' ' ' LEU . 0.0 OUTLIER -52.87 -53.76 44.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.746 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.571 ' CD1' HD22 ' A' ' 105' ' ' LEU . 1.1 mt -89.36 -18.98 7.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.363 -0.535 . . . . 0.85 110.586 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 123' ' ' GLU . 14.2 ttm180 -65.16 -35.47 81.2 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 108.916 -0.772 . . . . 1.7 108.916 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.422 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 7.0 tt0 -74.42 -16.32 60.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.952 -1.022 . . . . 1.55 109.19 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.63 31.81 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.19 -0.913 . . . . 0.66 110.594 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -112.36 112.95 24.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.401 0.619 . . . . 0.8 110.331 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mt -106.11 -36.78 3.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.358 -0.837 . . . . 1.23 110.817 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.42 -29.99 64.22 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.749 0.277 . . . . 1.35 111.749 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 93.46 21.95 27.98 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.543 -0.837 . . . . 1.25 112.367 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.577 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 1.6 p-10 -89.11 -9.32 51.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.903 0.383 . . . . 1.06 110.716 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.69 -2.74 85.29 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.955 -0.64 . . . . 0.9 112.944 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.577 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 12.6 mt-30 -120.38 169.76 10.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.959 0.409 . . . . 1.18 110.284 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.662 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -116.12 105.29 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.466 -0.788 . . . . 1.08 109.309 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.578 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.6 p30 -95.73 175.71 6.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.808 -0.633 . . . . 0.84 109.958 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.443 ' O ' HG23 ' A' ' 142' ' ' VAL . 50.2 t80 -51.61 -45.33 63.17 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.467 0.479 . . . . 1.45 111.624 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.79 -50.4 74.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.707 -0.679 . . . . 1.84 112.028 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.578 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 23.6 mt-10 -72.74 -32.8 65.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.076 0.465 . . . . 0.68 111.197 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.8 -53.17 59.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.85 112.085 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 138' ' ' TYR . 61.9 t -61.23 -40.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 111.961 0.356 . . . . 1.23 111.961 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -67.47 -28.44 67.86 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.197 -0.201 . . . . 1.96 111.485 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.422 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -64.2 -48.94 73.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.142 0.496 . . . . 0.89 110.907 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.728 ' HG2' HD22 ' B' ' 296' ' ' LEU . 1.9 mpt? -77.27 -36.42 54.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.952 -0.567 . . . . 1.14 111.25 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.7 55.92 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.235 0.541 . . . . 1.53 110.554 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.18 127.89 32.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.478 -0.783 . . . . 1.64 110.605 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.945 -0.57 . . . . 3.35 110.128 179.743 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 110.197 -0.297 . . . . 2.21 110.197 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.503 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -90.23 -30.56 17.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.905 0.383 . . . . 1.57 110.532 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -49.21 -39.0 28.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.202 -0.908 . . . . 1.18 112.686 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.443 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.0 p-10 -88.5 -22.96 23.36 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.013 0.375 . . . . 1.07 112.013 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.758 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 6.9 tp -73.57 -43.27 60.23 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 118.739 -0.648 . . . . 1.52 111.878 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.662 ' CH2' HG21 ' A' ' 136' ' ' VAL . 66.6 m95 -52.96 -52.47 64.89 Favored Pre-proline 0 CA--C 1.552 1.044 0 CA-C-N 119.262 0.937 . . . . 0.48 109.663 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 41.4 Cg_exo -60.33 -23.16 73.65 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.861 1.708 . . . . 0.61 112.028 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 50.9 m -55.93 -64.79 1.93 Allowed Pre-proline 0 CA--C 1.546 0.821 0 CA-C-O 118.355 -0.831 . . . . 0.67 110.834 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 51.5 Cg_exo -57.85 -31.74 93.22 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 121.572 1.597 . . . . 0.58 111.561 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.728 HD22 ' HG2' ' A' ' 145' ' ' MET . 2.6 tp -61.15 -46.16 91.69 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.195 0.522 . . . . 0.94 109.681 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 51.0 ttm -66.99 -39.1 87.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.799 -0.637 . . . . 1.48 109.47 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.523 HG12 ' O ' ' B' ' 294' ' ' SER . 30.7 mm -61.73 -32.43 53.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.734 . . . . 0.7 109.944 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -66.85 -45.97 76.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.06 -0.518 . . . . 1.21 110.246 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.82 -34.22 77.66 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.458 -0.571 . . . . 2.51 109.458 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 15.3 m -70.73 -34.78 72.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.573 -0.739 . . . . 0.81 109.197 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -69.98 -34.89 73.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.183 -0.673 . . . . 2.25 109.183 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -63.33 -40.08 96.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.388 -0.968 . . . . 1.76 108.388 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -69.13 -38.18 78.7 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.815 -1.084 . . . . 1.62 109.417 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-N 115.649 -0.705 . . . . 1.68 109.471 178.275 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 111.555 0.205 . . . . 2.61 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.54 -44.57 89.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.769 0.318 . . . . 1.78 111.116 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.413 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -62.74 -45.91 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 1.33 110.821 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -63.52 -43.91 95.79 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 2.26 110.047 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.444 ' O ' HG23 ' A' ' 91' ' ' VAL . 19.9 mm-40 -64.09 -42.35 96.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 1.91 110.841 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.95 81.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.306 -0.407 . . . . 1.0 110.146 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -59.85 -38.58 82.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.949 -0.569 . . . . 0.86 110.168 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -65.46 -37.26 86.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 1.84 110.911 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.3 t -75.96 -35.54 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.089 0.471 . . . . 1.24 110.706 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -71.42 -36.93 71.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 1.06 110.54 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.551 ' HA ' ' OE1' ' A' ' 104' ' ' GLU . 28.7 t70 -81.06 84.46 6.5 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.765 -0.457 . . . . 0.95 109.765 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -85.89 -22.8 27.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.563 -0.744 . . . . 1.28 112.142 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -82.32 -11.0 58.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.977 0.418 . . . . 1.36 110.97 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.65 48.04 71.32 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.887 -0.597 . . . . 1.02 113.692 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -115.13 -6.1 12.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.99 0.395 . . . . 0.86 110.536 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 79.54 14.13 81.67 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.944 -0.646 . . . . 0.67 112.722 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -139.16 149.54 44.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.703 0.287 . . . . 1.29 110.747 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.467 ' HB ' HG12 ' A' ' 136' ' ' VAL . 6.0 mt -94.4 103.16 14.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.956 -0.757 . . . . 0.56 108.956 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -83.56 162.47 20.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.579 -0.737 . . . . 1.33 109.442 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.51 -36.13 73.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.004 0.43 . . . . 0.75 110.399 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.92 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.89 110.555 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' A' ' 93' ' ' ASP . 45.0 mt-10 -67.64 -40.37 84.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 0.86 110.825 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 5.0 tp -75.12 -26.03 58.89 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.11 0.481 . . . . 0.54 110.258 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -68.09 -13.86 62.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.238 -0.653 . . . . 2.15 109.238 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -106.33 15.78 25.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.083 -0.962 . . . . 1.21 109.024 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 104' ' ' GLU . 74.7 t -120.04 -54.92 3.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.445 -0.798 . . . . 0.72 109.622 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.571 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -69.0 -12.39 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.381 -0.827 . . . . 1.6 111.301 -179.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -37.34 68.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.159 -0.682 . . . . 1.67 109.159 178.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -79.03 -16.74 56.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.953 -1.021 . . . . 1.85 109.115 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 109' ' ' MET . 45.5 tp -67.04 -17.24 64.81 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.06 -0.973 . . . . 1.23 109.825 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 104.29 -70.52 0.26 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.667 -0.697 . . . . 1.13 112.128 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -61.78 106.33 0.67 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.989 0.423 . . . . 2.09 111.158 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -100.29 91.45 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.023 -0.535 . . . . 1.92 109.795 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.2 mt -77.33 178.84 6.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.281 -0.872 . . . . 1.27 111.105 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -77.8 172.28 13.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.349 . . . . 1.08 111.699 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -56.09 -48.57 75.88 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.093 -0.503 . . . . 1.99 111.802 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -64.49 -35.06 79.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 2.75 111.055 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.81 -39.61 79.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.884 0.373 . . . . 1.14 110.081 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.8 t -68.65 -36.89 76.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.975 -0.75 . . . . 0.86 108.975 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 4.0 t70 -63.21 -47.71 81.37 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.454 -0.943 . . . . 1.38 108.454 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.592 ' HG2' ' NH2' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -56.49 -37.3 70.2 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.388 -0.824 . . . . 1.94 109.948 178.55 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.605 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 2.5 mtp -55.43 -50.26 70.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.278 -0.874 . . . . 0.66 111.29 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.578 HG23 HG23 ' A' ' 136' ' ' VAL . 0.9 OUTLIER -79.49 -27.01 12.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.124 -0.63 . . . . 0.85 110.946 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.592 ' NH2' ' HG2' ' A' ' 123' ' ' GLU . 80.1 mtm-85 -63.84 -31.35 72.5 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 108.273 -1.01 . . . . 1.7 108.273 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -72.78 -29.38 63.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 114.861 -1.063 . . . . 1.55 109.459 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.42 -0.24 54.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.415 -0.812 . . . . 0.66 111.528 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -106.9 116.41 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.265 0.555 . . . . 0.8 110.5 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.4 mt -109.51 -32.15 2.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.779 -0.646 . . . . 1.23 110.725 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -77.79 -14.93 59.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.883 0.373 . . . . 1.35 110.826 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.2 30.87 64.48 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.039 -0.601 . . . . 1.25 112.259 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.429 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -89.67 -10.83 44.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.014 0.435 . . . . 1.06 110.378 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 -12.57 68.72 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.141 -0.552 . . . . 0.9 112.753 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.429 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 6.1 mt-30 -120.67 173.08 7.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 1.18 110.929 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.635 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -115.86 105.92 19.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.673 -0.694 . . . . 1.08 109.752 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.539 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 2.2 p30 -90.3 173.09 8.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.363 -0.381 . . . . 0.84 110.039 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -52.37 -44.89 65.51 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.308 0.38 . . . . 1.45 111.623 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -57.2 -55.11 38.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 1.84 111.199 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.539 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 33.8 mt-10 -64.72 -42.75 95.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.327 -0.397 . . . . 0.68 110.565 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -53.51 -58.0 8.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.647 -0.706 . . . . 0.85 111.436 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 65.1 t -65.81 -51.95 55.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.069 -0.514 . . . . 1.23 111.953 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -56.65 -42.82 79.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.724 0.638 . . . . 1.96 112.724 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -41.3 96.71 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.945 0.35 . . . . 0.89 111.945 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.504 ' SD ' HD22 ' B' ' 296' ' ' LEU . 10.1 mtt -81.25 -31.02 33.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.412 -0.358 . . . . 1.14 111.351 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.2 m -87.98 59.9 5.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.429 0.633 . . . . 1.53 110.596 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 137.14 36.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.448 -0.796 . . . . 1.64 110.237 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.094 -0.955 . . . . 3.35 109.974 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 109.92 -0.4 . . . . 2.21 109.92 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -116.9 -15.01 10.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.15 -0.477 . . . . 1.57 110.8 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -59.46 -18.84 43.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.399 -0.819 . . . . 1.18 112.594 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.422 ' ND2' HD12 ' B' ' 291' ' ' LEU . 13.7 p-10 -91.11 -32.03 16.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 120.822 0.344 . . . . 1.07 111.527 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.477 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.8 mp -70.09 -42.58 72.54 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 118.937 -0.554 . . . . 1.52 111.441 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' A' ' 136' ' ' VAL . 65.5 m95 -53.48 -54.63 43.47 Favored Pre-proline 0 CA--C 1.555 1.165 0 CA-C-N 118.915 0.779 . . . . 0.48 110.387 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 43.6 Cg_exo -60.75 -20.11 64.32 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.822 1.681 . . . . 0.61 112.229 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 73.9 m -58.5 -64.2 3.13 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.987 -1.006 . . . . 0.67 110.116 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 75.9 Cg_exo -54.57 -31.77 71.44 Favored 'Trans proline' 0 C--N 1.372 1.801 0 CA-C-N 121.978 1.742 . . . . 0.58 111.374 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.504 HD22 ' SD ' ' A' ' 145' ' ' MET . 6.0 tp -61.62 -48.11 82.36 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.592 0.711 . . . . 0.94 109.5 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 32.9 ttm -67.73 -30.21 69.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.625 -0.716 . . . . 1.48 109.232 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.564 HG12 ' O ' ' B' ' 294' ' ' SER . 40.2 mm -68.36 -28.72 41.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 108.886 -0.783 . . . . 0.7 108.886 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -39.95 92.0 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.992 -1.114 . . . . 1.21 107.992 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -66.2 -40.22 90.24 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.454 -0.794 . . . . 2.51 109.093 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 7.2 m -68.39 -36.22 78.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.407 -0.815 . . . . 0.81 109.551 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -69.47 -34.7 74.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.497 -0.774 . . . . 2.25 109.36 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -33.49 75.44 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.572 -0.899 . . . . 1.76 108.572 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -72.38 -46.56 54.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.301 -0.863 . . . . 1.62 109.498 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 N--CA 1.456 -0.145 0 CA-C-N 116.071 -0.513 . . . . 1.68 109.914 179.056 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--O 1.231 0.082 0 N-CA-C 111.619 0.229 . . . . 2.61 111.619 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.28 -43.07 92.56 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.771 0.286 . . . . 1.78 111.771 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 mt -66.2 -43.63 91.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.832 0.348 . . . . 1.33 110.796 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 86' ' ' ARG . 38.5 ttt-85 -62.62 -42.26 99.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.003 -0.544 . . . . 2.26 110.642 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 91' ' ' VAL . 70.9 tt0 -75.23 -33.09 61.3 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 1.91 111.167 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.61 -45.35 81.51 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.824 0.345 . . . . 1.0 110.427 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -60.56 -39.13 86.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.883 -0.599 . . . . 0.86 110.436 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.435 ' NH2' ' HA2' ' A' ' 96' ' ' GLY . 6.8 tpm_? -67.63 -31.32 71.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 1.84 110.771 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.1 t -78.53 -42.96 26.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 1.24 111.239 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.08 -40.76 82.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 1.06 110.91 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.78 76.93 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.044 -0.724 . . . . 0.95 109.044 178.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -71.07 -28.54 64.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.225 -0.898 . . . . 1.28 111.441 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.448 ' OD1' ' HB3' ' A' ' 97' ' ' ASN . 0.0 OUTLIER -70.11 -24.17 63.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.78 -0.368 . . . . 1.36 110.473 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.435 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 71.3 58.42 5.54 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.063 -0.589 . . . . 1.02 113.856 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.448 ' HB3' ' OD1' ' A' ' 95' ' ' ASP . 14.9 p-10 -128.72 -8.12 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.234 0.54 . . . . 0.86 110.677 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.46 65.65 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.553 -0.832 . . . . 0.67 112.151 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.583 ' CE1' ' HB3' ' A' ' 137' ' ' ASN . 40.2 m-85 -140.38 124.87 17.89 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.586 0.232 . . . . 1.29 110.611 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 HD13 ' A' ' 105' ' ' LEU . 8.0 mt -79.03 102.79 5.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.917 -0.772 . . . . 0.56 108.917 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.3 m -77.55 161.95 27.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.51 -0.768 . . . . 1.33 110.408 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.95 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.422 . . . . 0.75 110.522 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.81 71.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 0.89 111.132 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -75.99 -41.56 50.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 0.86 110.388 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.592 HD13 HG21 ' A' ' 100' ' ' ILE . 5.5 tp -74.63 -31.64 62.05 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.199 -0.455 . . . . 0.54 111.191 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.465 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 50.3 mtm-85 -57.16 -35.62 69.77 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.224 0.535 . . . . 2.15 110.041 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -69.53 -36.92 76.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.766 -0.652 . . . . 1.21 109.319 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.0 t -66.31 -41.15 88.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.427 -0.806 . . . . 0.72 109.792 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -27.12 69.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.062 0.458 . . . . 1.6 110.604 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 21.7 m -71.49 -35.11 70.68 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.317 0.579 . . . . 1.67 109.565 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -88.09 -3.04 58.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.659 -0.701 . . . . 1.85 109.856 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.8 tp -85.79 -0.49 55.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.296 -0.866 . . . . 1.23 110.13 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.31 -62.81 4.43 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.714 -0.675 . . . . 1.13 111.724 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -74.64 96.13 2.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.987 0.423 . . . . 2.09 110.615 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -81.02 99.35 8.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 1.92 109.917 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.7 mt -90.53 167.1 12.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.606 -0.725 . . . . 1.27 110.668 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.4 p -73.06 166.19 23.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.347 -0.388 . . . . 1.08 110.909 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.465 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 27.9 t0 -57.91 -43.06 85.94 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.511 0.189 . . . . 1.99 111.511 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -62.45 -35.32 78.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.667 0.27 . . . . 2.75 110.546 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -69.36 -38.64 78.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.779 -0.452 . . . . 1.14 109.779 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 117' ' ' THR . 55.5 t -68.26 -36.88 76.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.907 -0.775 . . . . 0.86 108.907 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -64.02 -42.65 97.06 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.897 -0.779 . . . . 1.38 108.897 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.53 -34.51 77.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.252 -0.885 . . . . 1.94 109.186 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.754 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 4.8 mtp -61.21 -50.1 74.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.66 110.683 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.755 HG23 HG13 ' A' ' 136' ' ' VAL . 0.7 OUTLIER -75.43 -24.38 17.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.771 -0.372 . . . . 0.85 110.388 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -66.78 -29.46 69.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.657 -0.868 . . . . 1.7 108.657 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -82.76 -20.7 35.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.826 -1.079 . . . . 1.55 109.558 178.513 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -99.91 -2.36 34.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.666 -0.697 . . . . 0.66 111.363 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -106.47 112.15 25.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.147 -0.479 . . . . 0.8 109.794 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mt -107.68 -22.47 4.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.229 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -85.39 -13.43 49.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.808 0.337 . . . . 1.35 111.677 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.01 45.08 12.22 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.94 -0.648 . . . . 1.25 113.559 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.45 -13.52 13.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.008 0.433 . . . . 1.06 110.301 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.47 -36.92 3.96 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.801 -0.714 . . . . 0.9 112.745 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -107.67 172.3 6.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.066 0.46 . . . . 1.18 110.894 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.755 HG13 HG23 ' A' ' 125' ' ' ILE . 17.0 m -107.73 118.59 55.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.206 -0.664 . . . . 1.08 109.206 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.583 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.1 p30 -92.83 177.2 6.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.669 -0.493 . . . . 0.84 109.669 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -50.19 -49.1 53.58 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 123.192 0.308 . . . . 1.45 111.783 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.91 -54.98 41.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 1.84 111.257 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.0 -42.73 98.98 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.391 -0.368 . . . . 0.68 111.007 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -53.54 -55.28 26.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.69 -0.686 . . . . 0.85 111.121 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 56.2 t -69.98 -41.1 79.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.979 -0.555 . . . . 1.23 111.892 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.76 -43.99 87.2 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.517 0.562 . . . . 1.96 112.517 -178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.4 tmt? -67.28 -45.24 77.2 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.862 0.319 . . . . 0.89 111.862 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.434 ' SD ' HD13 ' B' ' 296' ' ' LEU . 29.5 mtt -72.85 -50.89 21.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.235 -0.438 . . . . 1.14 111.844 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -90.01 50.47 1.88 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.46 0.648 . . . . 1.53 111.158 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.02 66.06 4.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.75 -0.659 . . . . 1.64 110.301 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.251 -0.881 . . . . 3.35 109.747 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.022 -0.362 . . . . 2.21 110.022 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.754 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -46.33 -40.51 11.92 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.604 0.565 . . . . 1.57 112.215 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -47.6 -45.4 27.46 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.837 0.711 . . . . 1.18 112.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -91.56 -22.71 20.2 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 112.307 0.484 . . . . 1.07 112.307 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.471 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 0.1 OUTLIER -68.76 -55.5 11.08 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 118.668 -0.682 . . . . 1.52 112.067 -178.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.605 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 84.0 m95 -49.1 -52.48 47.39 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 118.867 0.758 . . . . 0.48 110.869 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 57.6 Cg_exo -56.69 -28.47 75.66 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 122.035 1.823 . . . . 0.61 112.901 178.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 38.1 m -56.35 -62.72 4.35 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-O 118.358 -0.83 . . . . 0.67 110.915 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 64.8 Cg_exo -55.14 -31.63 76.39 Favored 'Trans proline' 0 C--N 1.369 1.645 0 CA-C-N 121.297 1.499 . . . . 0.58 111.677 176.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.434 HD13 ' SD ' ' A' ' 145' ' ' MET . 10.4 tp -64.82 -42.88 94.62 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.546 0.689 . . . . 0.94 109.487 178.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 46.0 ttm -66.25 -31.04 71.61 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.399 -0.963 . . . . 1.48 108.399 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 294' ' ' SER . 38.6 mm -64.85 -30.51 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 115.135 -0.939 . . . . 0.7 109.537 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -39.05 87.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.235 -1.024 . . . . 1.21 108.235 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -61.38 -43.53 98.71 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.336 -0.987 . . . . 2.51 108.336 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.6 m -67.12 -34.69 78.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.81 110.133 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 302' ' ' LYS . 25.5 tptt -68.78 -32.27 71.88 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.467 -0.568 . . . . 2.25 109.467 178.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -63.92 -36.46 84.03 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.747 -1.205 . . . . 1.76 107.747 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -66.63 -39.64 88.38 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.628 -1.169 . . . . 1.62 108.77 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-N 115.731 -0.668 . . . . 1.68 109.946 178.584 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 . . . . . 0 CA--C 1.52 -0.189 0 N-CA-C 111.639 0.237 . . . . 2.61 111.639 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.21 -43.73 83.04 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.024 0.44 . . . . 1.78 109.961 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.39 -46.2 81.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.496 -0.775 . . . . 1.33 110.983 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -63.25 -44.64 94.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.739 0.304 . . . . 2.26 110.773 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 91' ' ' VAL . 30.7 tt0 -65.03 -40.6 95.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.092 -0.504 . . . . 1.91 110.149 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.74 -46.68 81.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.08 -42.7 86.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.628 -0.715 . . . . 0.86 110.33 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -65.34 -42.97 92.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.838 -0.619 . . . . 1.84 111.162 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.523 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 89.8 t -68.33 -34.51 66.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.177 -0.465 . . . . 1.24 110.866 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.71 -38.16 64.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.33 -0.396 . . . . 1.06 110.126 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.445 ' HA ' ' OE2' ' A' ' 104' ' ' GLU . 32.0 t70 -82.48 81.59 8.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.362 0.601 . . . . 0.95 109.88 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 8.6 mttt -81.73 -15.9 52.89 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.507 -0.769 . . . . 1.28 111.766 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -81.77 -26.74 34.19 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.603 -0.439 . . . . 1.36 110.473 -179.425 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.46 23.39 40.13 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.805 -0.712 . . . . 1.02 114.848 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.428 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 12.7 p-10 -96.92 -8.51 30.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.781 0.791 . . . . 0.86 111.127 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.05 20.8 66.8 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.772 -0.728 . . . . 0.67 112.334 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -144.62 130.67 19.43 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.888 -0.412 . . . . 1.29 109.888 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.597 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 65.7 mt -76.44 102.21 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.163 -0.68 . . . . 0.56 109.163 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -81.27 165.72 21.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.12 -0.491 . . . . 1.33 109.692 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.59 68.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.802 0.334 . . . . 0.75 111.283 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.77 -42.41 70.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.072 0.463 . . . . 0.89 110.199 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 108' ' ' VAL . 41.4 mt-10 -70.16 -37.06 75.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.556 -0.747 . . . . 0.86 110.304 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.679 HD22 HG12 ' A' ' 125' ' ' ILE . 19.2 tp -67.88 -29.39 68.48 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.329 0.585 . . . . 0.54 109.782 178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -76.91 5.11 8.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.461 -0.79 . . . . 2.15 109.926 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -125.31 16.2 8.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.303 -0.862 . . . . 1.21 109.066 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 104' ' ' GLU . 94.0 t -120.59 -66.87 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.633 -0.712 . . . . 0.72 110.535 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.478 ' HG2' ' SD ' ' A' ' 124' ' ' MET . 0.8 OUTLIER -67.77 -18.88 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.672 -0.695 . . . . 1.6 111.323 -178.788 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -45.88 51.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.653 0.74 . . . . 1.67 109.383 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.87 -25.29 65.45 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 114.972 -1.013 . . . . 1.85 109.389 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.472 HD22 ' HD3' ' B' ' 295' ' ' PRO . 11.6 tp -60.28 -25.59 65.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.865 -1.061 . . . . 1.23 110.554 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.98 -35.18 4.28 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.921 -0.657 . . . . 1.13 111.903 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -66.91 102.64 0.99 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.0 0.429 . . . . 2.09 111.001 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -85.2 85.51 7.46 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.897 -0.592 . . . . 1.92 109.901 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.425 HD11 HD22 ' B' ' 291' ' ' LEU . 73.0 mt -95.57 162.61 13.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.577 -0.738 . . . . 1.27 111.45 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 22.3 p -87.14 170.56 11.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.352 -0.84 . . . . 1.08 110.524 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -55.94 -42.7 76.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 1.99 110.921 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.55 -39.89 92.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.288 -0.415 . . . . 2.75 110.753 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.87 -37.23 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 1.14 110.248 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 124' ' ' MET . 56.1 t -67.19 -36.24 76.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.8 -0.815 . . . . 0.86 108.8 177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 23.5 t70 -63.59 -43.12 97.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.34 -0.846 . . . . 1.38 109.395 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.11 -34.69 78.16 Favored 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 109.406 -0.59 . . . . 1.94 109.406 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.689 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 5.6 mtp -60.07 -50.77 72.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.565 -0.743 . . . . 0.66 110.499 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.967 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -75.45 -22.81 16.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.664 -0.414 . . . . 0.85 110.197 179.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 10.2 ttm180 -67.05 -23.6 65.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.289 -0.634 . . . . 1.7 109.289 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -92.55 -19.39 22.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.036 -0.984 . . . . 1.55 110.729 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -97.44 -41.22 8.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.893 0.331 . . . . 0.66 111.893 -179.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.433 ' HB2' HD12 ' A' ' 125' ' ' ILE . 19.6 t0 -79.87 106.99 12.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.22 0.534 . . . . 0.8 110.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -99.64 -34.09 4.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.565 -0.743 . . . . 1.23 110.972 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -74.55 -23.59 58.81 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.631 0.253 . . . . 1.35 111.242 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.04 29.4 34.31 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.77 -0.729 . . . . 1.25 112.743 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -84.92 -20.3 30.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.901 0.381 . . . . 1.06 110.32 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.03 -7.9 59.04 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 121.031 -0.604 . . . . 0.9 112.943 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -128.26 163.71 24.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.392 0.615 . . . . 1.18 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.967 HG22 HD11 ' A' ' 125' ' ' ILE . 0.1 OUTLIER -99.73 101.15 11.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.188 -0.915 . . . . 1.08 108.826 178.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -86.34 171.61 11.06 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.768 -0.373 . . . . 0.84 110.579 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -51.71 -50.41 60.57 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.498 0.499 . . . . 1.45 111.957 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.67 -55.03 39.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.604 -0.271 . . . . 1.84 111.463 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.55 -43.45 97.21 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.816 0.341 . . . . 0.68 110.547 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -55.03 -54.26 45.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.603 -0.726 . . . . 0.85 111.178 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 89.9 t -70.16 -43.89 78.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 1.23 112.045 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -63.35 -44.0 96.09 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.333 0.494 . . . . 1.96 112.333 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.75 72.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.804 0.298 . . . . 0.89 111.804 -178.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.537 ' SD ' HD13 ' B' ' 296' ' ' LEU . 34.9 mtt -71.95 -47.7 50.46 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.993 0.368 . . . . 1.14 111.993 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 47.62 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.379 0.609 . . . . 1.53 110.527 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.59 130.27 41.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.424 -0.807 . . . . 1.64 110.268 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.188 -0.911 . . . . 3.35 109.843 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.854 0.359 . . . . 2.21 110.42 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.689 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -134.84 -10.29 2.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 1.57 111.168 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -56.39 -21.94 28.18 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 115.754 -0.657 . . . . 1.18 112.092 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.435 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 12.5 p-10 -92.0 -29.45 16.6 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.038 0.447 . . . . 1.07 111.315 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.567 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -72.21 -41.24 67.14 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-O 118.552 -0.737 . . . . 1.52 112.946 -177.685 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.647 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 66.0 m95 -57.73 -50.7 86.67 Favored Pre-proline 0 C--O 1.246 0.882 0 CA-C-N 119.546 1.066 . . . . 0.48 109.179 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 52.3 Cg_exo -58.34 -21.24 51.99 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.481 1.454 . . . . 0.61 111.735 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.57 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 69.4 m -57.63 -63.47 3.75 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-O 118.08 -0.962 . . . . 0.67 110.102 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.604 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 74.3 Cg_exo -55.72 -29.95 73.59 Favored 'Trans proline' 0 C--N 1.376 2.009 0 CA-C-N 121.815 1.684 . . . . 0.58 111.361 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.537 HD13 ' SD ' ' A' ' 145' ' ' MET . 5.1 tp -65.25 -44.18 88.97 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.328 0.585 . . . . 0.94 109.763 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 69.2 mtm -68.17 -31.23 70.63 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.235 -1.024 . . . . 1.48 108.235 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.495 HG12 ' O ' ' B' ' 294' ' ' SER . 38.1 mm -66.84 -28.94 44.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 N-CA-C 108.752 -0.833 . . . . 0.7 108.752 177.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -42.41 93.06 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.565 -0.902 . . . . 1.21 108.565 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -70.53 -35.76 73.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.632 -0.713 . . . . 2.51 109.507 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 13.6 m -67.52 -44.9 77.27 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.407 -0.59 . . . . 0.81 109.407 178.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' B' ' 298' ' ' ILE . 0.1 OUTLIER -64.22 -36.24 83.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.592 -0.731 . . . . 2.25 109.237 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 23.6 tttp -58.12 -44.31 87.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.644 -0.707 . . . . 1.76 109.462 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -68.59 -44.92 73.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.808 . . . . 1.62 109.982 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 1.68 110.538 179.358 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 N--CA 1.464 0.232 0 CA-C-O 120.819 0.343 . . . . 2.61 110.846 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.2 -34.66 73.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 1.78 110.502 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.544 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -65.4 -46.73 89.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.989 -0.55 . . . . 1.33 110.829 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -59.09 -44.22 91.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.108 -0.496 . . . . 2.26 110.576 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.433 ' CD ' ' HZ1' ' B' ' 299' ' ' LYS . 1.0 OUTLIER -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.813 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.73 80.75 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.136 0.493 . . . . 1.0 109.982 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -62.02 -38.72 89.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.241 -0.89 . . . . 0.86 110.163 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -71.86 -27.8 63.12 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.79 -0.641 . . . . 1.84 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.8 t -83.13 -45.04 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.378 -0.373 . . . . 1.24 111.258 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -66.69 -32.64 74.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.3 -0.409 . . . . 1.06 110.994 -179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -83.73 91.42 7.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.91 -0.774 . . . . 0.95 108.91 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -85.27 -33.28 22.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.831 -0.622 . . . . 1.28 112.116 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.465 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -69.14 -29.27 67.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.678 -0.409 . . . . 1.36 110.293 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.86 28.28 26.62 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.011 -0.614 . . . . 1.02 114.267 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.467 HD21 ' HB2' ' A' ' 99' ' ' TYR . 20.0 p-10 -90.8 -8.22 50.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 117.729 0.764 . . . . 0.86 110.781 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.0 17.5 61.15 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.831 -0.699 . . . . 0.67 111.728 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HB2' HD21 ' A' ' 97' ' ' ASN . 98.6 m-85 -144.54 145.32 31.77 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.76 0.314 . . . . 1.29 110.346 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.606 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 38.1 mt -90.85 100.81 11.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.954 -0.566 . . . . 0.56 109.65 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -79.35 163.19 25.06 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 1.33 110.442 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.02 -43.01 81.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 0.75 110.093 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.08 91.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.871 -0.604 . . . . 0.89 110.839 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.5 mt-10 -69.46 -37.83 77.49 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.537 -0.756 . . . . 0.86 111.036 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.603 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.1 tp -72.92 -29.79 63.4 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.766 0.317 . . . . 0.54 110.4 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.475 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 31.0 mtm-85 -61.31 -32.68 72.54 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.013 0.435 . . . . 2.15 110.306 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -82.26 -6.45 59.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.495 0.664 . . . . 1.21 110.686 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 104' ' ' GLU . 85.6 t -92.54 -51.82 10.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.902 -0.59 . . . . 0.72 110.288 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.544 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -69.22 -16.91 63.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.756 -0.656 . . . . 1.6 112.151 -178.69 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.432 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 0.4 OUTLIER -72.1 -35.84 69.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.934 0.397 . . . . 1.67 109.969 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -76.54 -20.47 56.84 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.675 -0.693 . . . . 1.85 109.864 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.59 HD11 ' HB3' ' B' ' 294' ' ' SER . 59.3 tp -71.96 -10.75 60.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.219 -0.901 . . . . 1.23 110.508 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 92.62 -42.72 2.66 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.797 -0.716 . . . . 1.13 111.342 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.02 75.69 5.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 2.09 110.148 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 57.3 mttp -73.66 113.02 10.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.441 -0.8 . . . . 1.92 110.545 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.97 179.85 4.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.912 -0.586 . . . . 1.27 110.06 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.3 p -87.32 171.09 10.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.475 -0.33 . . . . 1.08 110.845 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.475 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 25.1 t0 -59.19 -42.39 90.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.327 -0.397 . . . . 1.99 111.443 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -42.4 99.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.751 0.31 . . . . 2.75 110.534 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -65.02 -37.79 88.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 1.14 110.326 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 124' ' ' MET . 61.9 t -69.47 -40.86 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.724 -0.473 . . . . 0.86 109.724 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.47 -40.03 94.93 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.502 -0.555 . . . . 1.38 109.502 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -64.78 -34.0 77.31 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 109.161 -0.681 . . . . 1.94 109.161 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.676 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 8.0 mtp -60.87 -45.92 92.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 0.66 110.006 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.827 HG23 HG13 ' A' ' 136' ' ' VAL . 0.4 OUTLIER -77.79 -19.78 13.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.593 -0.443 . . . . 0.85 109.832 179.14 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -68.99 -30.25 68.62 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.11 -1.07 . . . . 1.7 108.11 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -88.36 -11.19 46.96 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.422 -1.263 . . . . 1.55 109.206 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -109.23 1.27 20.12 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.594 -0.73 . . . . 0.66 112.11 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -115.17 129.06 56.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.633 -0.506 . . . . 0.8 109.633 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.93 -33.59 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.255 -0.43 . . . . 1.23 111.132 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.463 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 1.4 p-10 -69.96 -25.3 63.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.874 0.369 . . . . 1.35 111.11 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.49 64.84 1.32 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.467 -0.873 . . . . 1.25 111.795 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.463 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.7 OUTLIER -131.45 -18.27 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.679 0.276 . . . . 1.06 110.793 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.47 -25.86 26.74 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.577 -0.82 . . . . 0.9 113.065 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -116.44 176.1 5.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 1.18 110.216 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.827 HG13 HG23 ' A' ' 125' ' ' ILE . 30.0 m -106.82 122.01 60.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 1.08 108.692 178.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.406 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 28.7 p30 -94.57 -177.99 4.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.426 -0.352 . . . . 0.84 110.17 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -55.92 -49.25 73.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.793 0.33 . . . . 1.45 111.694 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.73 -54.09 49.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.106 -0.497 . . . . 1.84 111.632 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.406 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 41.2 mt-10 -61.76 -39.69 92.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.341 -0.39 . . . . 0.68 111.758 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 11.3 t80 -56.39 -58.62 7.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.85 111.376 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 22.6 t -65.87 -37.06 79.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.224 -0.443 . . . . 1.23 111.366 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -62.54 -44.18 96.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 1.96 111.582 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -45.14 65.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.883 0.373 . . . . 0.89 110.796 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.47 ' CG ' HD22 ' B' ' 296' ' ' LEU . 0.2 OUTLIER -62.42 -39.3 92.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.098 -0.501 . . . . 1.14 111.659 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.57 37.52 2.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.104 0.478 . . . . 1.53 110.776 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.92 81.7 8.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.151 -0.477 . . . . 1.64 111.006 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.389 -0.815 . . . . 3.35 109.538 179.489 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.821 0.343 . . . . 2.21 110.591 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.676 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.96 -41.77 97.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 1.57 111.566 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -45.77 -41.83 11.32 Favored 'General case' 0 C--O 1.223 -0.335 0 O-C-N 123.966 0.791 . . . . 1.18 113.032 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -90.73 -27.93 18.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.876 -0.33 . . . . 1.07 111.885 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' B' ' 294' ' ' SER . 2.5 tp -73.53 -44.85 56.65 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 113.004 0.742 . . . . 1.52 113.004 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.612 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 69.1 m95 -54.26 -53.66 56.58 Favored Pre-proline 0 CA--C 1.551 1.004 0 CA-C-N 119.534 1.061 . . . . 0.48 109.526 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 42.9 Cg_exo -61.35 -20.82 69.87 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 121.637 1.558 . . . . 0.61 112.428 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 43.4 m -55.97 -64.79 1.95 Allowed Pre-proline 0 CA--C 1.544 0.73 0 CA-C-O 118.381 -0.819 . . . . 0.67 110.375 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 46.0 Cg_exo -59.24 -31.23 94.83 Favored 'Trans proline' 0 C--N 1.37 1.689 0 CA-C-N 121.494 1.569 . . . . 0.58 111.234 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.1 tp -60.5 -46.39 90.29 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.186 0.517 . . . . 0.94 109.871 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 41.6 ttm -68.33 -31.82 71.49 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.361 -0.607 . . . . 1.48 109.361 178.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.583 HG12 ' O ' ' B' ' 294' ' ' SER . 43.4 mm -62.01 -34.97 65.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.856 -0.794 . . . . 0.7 108.856 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.433 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 2.6 tttp -66.39 -40.92 89.95 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.765 -0.652 . . . . 1.21 109.85 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -61.34 -42.62 98.98 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.886 -0.783 . . . . 2.51 108.886 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' B' ' 304' ' ' ASN . 6.4 m -70.55 -30.13 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.563 -0.744 . . . . 0.81 109.858 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 5.6 tptp -67.68 -33.75 75.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.172 -0.677 . . . . 2.25 109.172 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -65.81 -37.59 86.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.205 -1.035 . . . . 1.76 108.205 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' B' ' 301' ' ' SER . 22.6 t30 -63.86 -41.15 97.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.76 -1.109 . . . . 1.62 108.792 177.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.581 -0.736 . . . . 1.68 109.602 178.202 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 112.019 0.377 . . . . 2.61 112.019 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.47 -44.58 69.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.183 0.438 . . . . 1.78 112.183 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.632 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.4 mt -65.25 -41.43 91.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.993 0.425 . . . . 1.33 111.188 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -68.79 -43.79 74.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.055 -0.52 . . . . 2.26 110.827 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 mm-40 -70.79 -35.04 72.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.86 -0.609 . . . . 1.91 112.063 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.26 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.747 0.308 . . . . 1.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -59.19 -42.06 89.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.554 . . . . 0.86 110.377 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.06 -29.79 66.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.903 -0.59 . . . . 1.84 110.536 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.466 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 57.9 t -74.71 -41.09 47.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 1.24 110.438 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -71.89 -37.25 70.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.069 -0.514 . . . . 1.06 110.791 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -83.68 104.89 14.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.658 -0.497 . . . . 0.95 109.658 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 5.2 mptt -91.43 -39.29 12.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.089 -0.505 . . . . 1.28 111.224 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -69.48 -20.61 63.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.17 -0.468 . . . . 1.36 110.807 -178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.79 68.81 1.54 Allowed Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.153 -0.546 . . . . 1.02 112.774 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 24.2 p-10 -137.05 -0.41 2.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.891 0.377 . . . . 0.86 110.513 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.97 22.0 72.65 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.656 -0.783 . . . . 0.67 111.73 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.506 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 57.6 m-85 -142.82 122.86 13.63 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.688 0.28 . . . . 1.29 110.773 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.734 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 60.2 mt -82.13 102.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.712 -0.847 . . . . 0.56 108.712 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.6 t -76.32 163.29 27.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.592 -0.522 . . . . 1.33 109.592 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.5 -39.05 75.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.996 0.427 . . . . 0.75 110.459 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.91 88.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.89 110.508 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.71 -32.52 72.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.819 -0.628 . . . . 0.86 110.692 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.732 HD22 HG12 ' A' ' 125' ' ' ILE . 10.4 tp -77.27 -34.93 55.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.263 -0.426 . . . . 0.54 110.11 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.449 ' HG2' HG21 ' A' ' 121' ' ' VAL . 19.0 mtm180 -60.01 -34.22 73.05 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.515 -0.55 . . . . 2.15 109.515 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.09 -28.12 68.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.44 -0.8 . . . . 1.21 109.674 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.5 -35.33 44.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.72 109.998 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -34.77 73.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.214 -0.448 . . . . 1.6 110.345 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.469 HG23 ' HE3' ' A' ' 115' ' ' LYS . 1.3 m -63.8 -36.73 84.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.903 -0.589 . . . . 1.67 110.886 179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -84.74 -27.34 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.145 0.498 . . . . 1.85 109.952 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.84 -27.98 67.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.69 -0.686 . . . . 1.23 109.979 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.03 -49.77 0.86 Allowed Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.801 -0.636 . . . . 1.13 111.685 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.48 100.16 8.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.068 0.461 . . . . 2.09 110.019 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.469 ' HE3' HG23 ' A' ' 110' ' ' THR . 62.0 mttp -82.88 82.49 8.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.737 -0.665 . . . . 1.92 109.816 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.1 mt -72.54 166.66 22.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.689 -0.687 . . . . 1.27 111.691 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.4 p -77.4 168.67 19.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 1.08 111.095 -179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.18 -37.14 74.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.12 -0.491 . . . . 1.99 111.199 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -68.36 -37.36 80.38 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.894 0.378 . . . . 2.75 110.412 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -71.68 -34.28 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.784 -0.45 . . . . 1.14 109.784 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.449 HG21 ' HG2' ' A' ' 106' ' ' ARG . 77.0 t -67.78 -36.8 77.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.409 -0.96 . . . . 0.86 108.409 177.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 12.6 t70 -63.51 -41.99 98.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.131 -0.94 . . . . 1.38 108.572 177.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -60.65 -37.01 80.1 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.811 -0.631 . . . . 1.94 109.468 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.734 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 9.3 mtp -56.72 -51.46 68.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.218 -0.901 . . . . 0.66 111.777 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.732 HG12 HD22 ' A' ' 105' ' ' LEU . 1.4 mt -85.45 -14.07 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 119.077 -1.049 . . . . 0.85 111.382 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 20.0 ttm180 -68.11 -25.26 65.22 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.824 -1.176 . . . . 1.7 107.824 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.429 ' HB3' ' HB3' ' B' ' 288' ' ' ALA . 4.7 tt0 -97.5 -5.44 35.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 113.898 -1.501 . . . . 1.55 109.605 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.48 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -101.85 -44.59 5.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.16 -0.473 . . . . 0.66 111.733 -178.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -76.59 132.38 39.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.083 0.468 . . . . 0.8 111.179 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 37.4 mt -130.29 -23.59 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.799 -0.637 . . . . 1.23 110.893 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.473 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 1.1 p-10 -77.03 -22.4 53.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.426 -0.352 . . . . 1.35 111.828 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 98.62 -0.21 58.01 Favored Glycine 0 C--O 1.236 0.28 0 C-N-CA 120.434 -0.889 . . . . 1.25 113.699 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.473 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.1 OUTLIER -70.49 -24.68 62.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.277 0.538 . . . . 1.06 110.078 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.73 -8.17 59.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.852 -0.689 . . . . 0.9 113.461 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -123.89 -179.63 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.557 0.694 . . . . 1.18 111.169 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.734 ' CG2' ' HB ' ' A' ' 100' ' ' ILE . 0.0 OUTLIER -102.89 96.61 4.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 114.644 -1.162 . . . . 1.08 109.165 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 27.7 p30 -88.71 176.01 7.27 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.48 -0.488 . . . . 0.84 109.933 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -52.85 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.627 0.603 . . . . 1.45 112.627 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 30.5 mp0 -62.59 -50.82 69.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.457 -0.338 . . . . 1.84 111.776 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 39.4 mt-10 -62.67 -41.97 99.37 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.913 0.387 . . . . 0.68 110.706 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.427 ' HE2' ' O ' ' A' ' 85' ' ' ILE . 75.4 t80 -56.03 -56.25 23.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.535 -0.757 . . . . 0.85 111.365 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.42 -38.28 81.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.083 -0.508 . . . . 1.23 111.447 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.6 -41.52 92.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 1.96 111.429 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -38.94 62.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.039 0.447 . . . . 0.89 110.913 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.601 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -67.46 -47.64 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.495 . . . . 1.14 110.901 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.64 48.68 1.02 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.226 0.536 . . . . 1.53 109.895 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.45 101.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.671 -0.695 . . . . 1.64 110.804 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.308 -0.853 . . . . 3.35 109.833 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.723 0.297 . . . . 2.21 110.23 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.734 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -114.96 -33.9 5.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.254 -0.43 . . . . 1.57 111.178 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.33 -30.37 4.84 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 123.914 0.759 . . . . 1.18 112.344 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.483 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 20.3 p-10 -92.79 -34.18 13.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.302 0.482 . . . . 1.07 112.302 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.484 ' O ' ' HD3' ' B' ' 295' ' ' PRO . 9.6 mp -68.79 -46.66 68.14 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-O 118.3 -0.857 . . . . 1.52 112.724 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.609 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 59.8 m95 -52.98 -50.9 79.33 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-N 119.738 1.153 . . . . 0.48 109.927 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -64.01 -17.48 59.95 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 121.631 1.554 . . . . 0.61 112.385 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.584 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 74.2 m -60.32 -61.52 7.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-O 118.547 -0.739 . . . . 0.67 110.289 178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.592 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -60.88 -27.47 84.85 Favored 'Trans proline' 0 C--N 1.37 1.673 0 CA-C-N 121.481 1.565 . . . . 0.58 110.19 176.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 85' ' ' ILE . 4.4 tp -59.49 -47.74 84.33 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.041 -0.725 . . . . 0.94 109.041 177.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 50.3 ttm -67.33 -32.44 73.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.753 -0.658 . . . . 1.48 109.265 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.56 HG12 ' O ' ' B' ' 294' ' ' SER . 45.2 mm -65.66 -31.46 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.63 -0.714 . . . . 0.7 109.108 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -38.0 87.68 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.977 -1.12 . . . . 1.21 107.977 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' B' ' 303' ' ' LYS . 0.4 OUTLIER -65.36 -35.94 82.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.244 -0.889 . . . . 2.51 108.733 177.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.4 m -69.83 -36.43 75.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.659 -0.867 . . . . 0.81 108.659 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.5 tptp -67.75 -31.34 71.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.902 -0.777 . . . . 2.25 108.902 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . 0.415 ' HB3' ' O ' ' B' ' 300' ' ' ARG . 17.9 tttp -63.52 -43.73 96.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.214 -0.903 . . . . 1.76 108.794 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -69.49 -37.36 77.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.374 -0.83 . . . . 1.62 109.137 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.711 -0.677 . . . . 1.68 109.403 178.06 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.106 0.479 . . . . 2.61 110.313 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -57.54 -47.66 81.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.417 -0.811 . . . . 1.78 110.516 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.0 mt -72.02 -32.43 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.99 -0.55 . . . . 1.33 110.672 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -65.3 -45.79 82.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.116 -0.493 . . . . 2.26 110.157 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 91' ' ' VAL . 3.3 tt0 -66.62 -38.21 86.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 1.91 109.818 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.39 82.08 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.002 -0.544 . . . . 1.0 110.41 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.81 -40.9 89.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.86 110.407 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -66.33 -36.62 83.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.869 -0.605 . . . . 1.84 110.737 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 87' ' ' GLU . 58.6 t -71.84 -36.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.175 -0.466 . . . . 1.24 110.472 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 108' ' ' VAL . 3.7 m-30 -66.44 -54.03 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.476 . . . . 1.06 110.052 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -83.89 96.68 8.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.95 110.014 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -90.65 -34.6 15.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.71 -0.677 . . . . 1.28 111.63 -178.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.57 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 1.1 p-10 -68.72 -25.64 64.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.839 0.352 . . . . 1.36 110.7 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.28 44.02 7.19 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.853 -0.689 . . . . 1.02 113.121 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.57 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 4.8 p-10 -97.1 -7.56 32.38 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.731 -0.47 . . . . 0.86 109.731 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.2 0.7 76.71 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.848 -0.614 . . . . 0.67 113.576 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' A' ' 97' ' ' ASN . 71.3 m-85 -141.09 155.33 46.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.88 0.371 . . . . 1.29 110.639 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.674 ' HB ' HG23 ' A' ' 136' ' ' VAL . 84.9 mt -83.67 100.48 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.89 -0.781 . . . . 0.56 108.89 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -72.51 155.45 40.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.432 -0.349 . . . . 1.33 110.426 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.57 -35.81 75.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.119 0.485 . . . . 0.75 110.229 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.18 -37.89 81.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.89 109.972 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.51 -30.41 61.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.664 -0.698 . . . . 0.86 110.142 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.719 HD22 HG12 ' A' ' 125' ' ' ILE . 18.8 tp -72.15 -40.64 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.859 -0.609 . . . . 0.54 109.954 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 1.042 ' HG2' HG11 ' A' ' 121' ' ' VAL . 20.3 mtm180 -57.61 -33.35 68.14 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.466 -0.334 . . . . 2.15 110.586 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.795 -0.639 . . . . 1.21 109.744 179.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 92' ' ' PHE . 16.0 t -70.43 -40.82 78.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.724 -0.671 . . . . 0.72 110.403 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.616 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -61.12 -46.95 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.939 -0.573 . . . . 1.6 111.049 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.7 p -70.57 -32.58 70.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.885 0.374 . . . . 1.67 111.157 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -71.03 -28.16 64.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.285 -0.416 . . . . 1.85 110.156 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 51.7 tp -64.69 -29.56 70.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.82 -0.627 . . . . 1.23 110.465 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 111.3 -41.72 2.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.854 -0.688 . . . . 1.13 111.701 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -74.07 100.49 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.28 0.562 . . . . 2.09 109.784 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -81.87 123.13 28.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.509 -0.768 . . . . 1.92 111.268 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.0 mt -118.45 162.56 18.14 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.727 -0.67 . . . . 1.27 109.698 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.412 ' O ' HG23 ' A' ' 121' ' ' VAL . 26.6 p -75.07 168.22 20.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.992 -0.373 . . . . 1.08 109.992 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.3 -36.5 75.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.947 0.403 . . . . 1.99 110.249 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.01 -45.03 83.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.712 -0.677 . . . . 2.75 110.155 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.75 -38.41 86.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 1.14 110.708 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 1.042 HG11 ' HG2' ' A' ' 106' ' ' ARG . 85.1 t -67.12 -40.89 86.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.481 -0.563 . . . . 0.86 109.481 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.553 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 21.3 t70 -64.5 -40.07 94.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.046 -0.724 . . . . 1.38 109.046 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.04 -35.24 74.68 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.563 -0.532 . . . . 1.94 109.563 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.61 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -55.86 -45.08 78.59 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 0.66 109.763 178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.994 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -81.05 -27.82 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.845 -0.616 . . . . 0.85 111.202 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 44.2 mtm-85 -68.92 -19.93 64.21 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.451 0.643 . . . . 1.7 109.663 178.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.17 -13.28 26.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.056 -0.975 . . . . 1.55 109.876 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.751 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -102.44 -35.82 8.64 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.736 -0.666 . . . . 0.66 111.572 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -83.47 104.87 13.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.936 0.398 . . . . 0.8 110.294 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.66 -32.4 3.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.854 -0.612 . . . . 1.23 111.303 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.42 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 0.6 OUTLIER -74.8 -12.93 60.51 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 1.35 111.375 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 69.53 61.02 4.68 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.102 -0.57 . . . . 1.25 112.538 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.42 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.9 OUTLIER -118.46 -19.85 8.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.552 0.215 . . . . 1.06 110.669 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.27 -22.46 32.86 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.669 -0.777 . . . . 0.9 112.941 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -122.81 173.29 7.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 1.18 111.047 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.994 HG22 HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -101.02 109.83 26.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.531 -0.759 . . . . 1.08 109.233 179.497 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 24.4 p30 -89.69 174.13 7.91 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.399 -0.521 . . . . 0.84 110.152 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -55.36 -49.54 72.01 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.46 0.541 . . . . 1.45 112.46 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.92 -52.98 63.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.316 -0.402 . . . . 1.84 111.863 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.402 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 45.3 mt-10 -61.57 -37.14 82.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.68 110.624 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -56.55 -54.83 41.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.85 110.797 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.7 t -70.23 -41.36 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.798 -0.637 . . . . 1.23 111.423 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -58.34 -52.29 66.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 1.96 112.156 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.431 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -66.38 -44.2 83.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.268 -0.424 . . . . 0.89 112.028 -178.122 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.453 ' HE2' ' O ' ' B' ' 292' ' ' TRP . 36.4 mtt -69.1 -45.16 70.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.829 0.347 . . . . 1.14 111.702 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 63.14 2.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.026 0.441 . . . . 1.53 110.214 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -94.99 157.16 16.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.91 -0.586 . . . . 1.64 111.326 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.301 -0.857 . . . . 3.35 109.169 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.363 -0.606 . . . . 2.21 109.363 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.61 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -116.55 0.72 12.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.859 -0.61 . . . . 1.57 111.829 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -39.39 -29.88 0.06 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.645 0.98 . . . . 1.18 113.645 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.484 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 9.0 p-10 -83.66 -21.69 32.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 117.607 0.185 . . . . 1.07 111.305 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.825 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 2.1 mp -71.5 -40.02 70.43 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-O 118.999 -0.524 . . . . 1.52 111.343 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.656 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 64.1 m95 -56.4 -51.68 79.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 119.235 -0.986 . . . . 0.48 108.8 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 51.2 Cg_exo -60.15 -19.71 58.07 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.59 1.527 . . . . 0.61 112.354 176.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.531 ' O ' HG12 ' B' ' 298' ' ' ILE . 49.6 m -57.08 -63.66 3.41 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.802 -0.618 . . . . 0.67 110.29 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.825 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 11.2 Cg_endo -58.78 -29.61 90.29 Favored 'Trans proline' 0 C--N 1.369 1.61 0 CA-C-N 120.915 1.363 . . . . 0.58 110.94 176.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.442 HD13 ' SD ' ' A' ' 145' ' ' MET . 8.3 tp -64.57 -39.01 92.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.098 -0.705 . . . . 0.94 109.098 177.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 38.4 ttm -70.63 -32.81 70.27 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.655 -0.869 . . . . 1.48 108.655 178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.531 HG12 ' O ' ' B' ' 294' ' ' SER . 49.0 mm -65.42 -29.88 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 108.502 -0.925 . . . . 0.7 108.502 177.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -39.36 82.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.515 -0.921 . . . . 1.21 108.515 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -64.66 -39.81 94.33 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.58 -0.896 . . . . 2.51 108.58 177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 8.8 m -69.19 -36.35 77.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.14 -0.936 . . . . 0.81 109.468 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -64.53 -37.08 86.3 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.24 -0.652 . . . . 2.25 109.24 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -62.18 -43.61 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.833 -0.621 . . . . 1.76 109.356 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -68.12 -43.32 78.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.592 -0.731 . . . . 1.62 109.454 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.626 . . . . 1.68 109.988 179.509 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.738 0.304 . . . . 2.61 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.413 ' OE2' ' HE2' ' B' ' 299' ' ' LYS . 0.5 OUTLIER -60.62 -35.89 77.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 1.78 110.452 179.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.579 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.1 mt -71.98 -40.96 68.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.71 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG3' ' OH ' ' A' ' 138' ' ' TYR . 42.9 ttt-85 -65.71 -47.74 74.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.304 -0.407 . . . . 2.26 110.449 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 91' ' ' VAL . 21.7 mm-40 -68.43 -26.85 65.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 1.91 110.814 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.05 -38.62 89.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.114 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -59.62 -39.36 84.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.86 109.945 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -67.34 -38.88 85.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.894 -0.594 . . . . 1.84 110.185 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 87' ' ' GLU . 61.4 t -70.9 -35.58 60.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 1.24 110.484 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -69.13 -49.96 52.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.943 -0.571 . . . . 1.06 109.958 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -81.6 74.48 8.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.95 109.741 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -66.97 -28.81 68.57 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.28 111.763 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.43 ' OD2' ' HB3' ' A' ' 97' ' ' ASN . 0.0 OUTLIER -74.8 -31.32 61.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.825 0.345 . . . . 1.36 110.471 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.53 60.55 2.62 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.895 -0.669 . . . . 1.02 113.23 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 7.6 p-10 -122.99 -7.02 8.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.86 110.097 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.11 10.53 68.76 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.742 -0.663 . . . . 0.67 112.965 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -142.51 129.59 20.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.883 0.373 . . . . 1.29 111.221 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.62 ' HB ' HG22 ' A' ' 136' ' ' VAL . 54.9 mt -79.68 103.04 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.941 -0.763 . . . . 0.56 108.941 178.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 43.9 t -82.0 160.62 23.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.829 -0.623 . . . . 1.33 110.255 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.5 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.01 -39.09 80.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 0.75 110.304 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.37 -35.58 81.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.89 110.558 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.35 -36.96 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.976 -0.556 . . . . 0.86 110.055 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.556 HD22 ' CG1' ' A' ' 125' ' ' ILE . 12.4 tp -66.94 -34.5 77.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.254 0.549 . . . . 0.54 109.562 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 16.1 mtm180 -70.22 -15.69 62.96 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.879 -0.6 . . . . 2.15 110.198 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.92 4.3 52.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.321 0.581 . . . . 1.21 110.13 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.2 t -114.14 -49.44 5.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.41 -0.814 . . . . 0.72 109.276 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -8.42 51.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.883 . . . . 1.6 111.826 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.458 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -72.53 -41.55 65.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.366 0.603 . . . . 1.67 109.63 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -78.12 -14.56 59.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.415 -0.812 . . . . 1.85 109.919 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 294' ' ' SER . 9.4 tt -63.54 -32.62 74.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 1.23 110.135 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.57 -62.57 0.29 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.242 -0.743 . . . . 1.13 111.242 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.53 82.31 4.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.243 0.544 . . . . 2.09 110.161 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 110' ' ' THR . 34.8 mttp -81.73 111.16 17.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.713 -0.676 . . . . 1.92 110.214 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 HD22 ' B' ' 291' ' ' LEU . 0.1 OUTLIER -85.33 175.25 9.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.334 -0.394 . . . . 1.27 110.816 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.481 ' O ' HG23 ' A' ' 121' ' ' VAL . 37.0 p -73.61 163.62 27.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.386 -0.37 . . . . 1.08 110.903 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -61.48 -31.41 71.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.956 0.408 . . . . 1.99 110.211 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -64.31 -40.26 95.56 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.48 0.657 . . . . 2.75 109.404 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 116' ' ' LEU . 46.6 mt-10 -74.44 -33.19 62.87 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.328 -0.851 . . . . 1.14 110.223 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 117' ' ' THR . 81.8 t -61.43 -40.23 85.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 108.225 -1.028 . . . . 0.86 108.225 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.23 -45.0 95.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.653 -1.158 . . . . 1.38 109.531 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.61 -38.32 90.59 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.0 -0.546 . . . . 1.94 110.204 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.607 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 6.5 mtp -59.5 -48.0 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.66 111.136 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.635 HD13 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -73.97 -35.27 41.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 C-N-CA 120.539 -0.465 . . . . 0.85 110.414 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 126' ' ' ARG . 28.5 mtm180 -64.62 -34.05 77.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.051 0.453 . . . . 1.7 110.018 178.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -73.45 -17.78 61.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.485 0.66 . . . . 1.55 109.417 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB3' HG11 ' A' ' 136' ' ' VAL . . . -108.17 8.69 28.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.378 -0.828 . . . . 0.66 110.21 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -117.17 116.03 26.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.049 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.53 -29.45 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.155 -0.475 . . . . 1.23 110.734 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.534 ' OD2' ' HB3' ' A' ' 133' ' ' ASP . 0.6 OUTLIER -77.22 -15.24 59.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 1.35 110.64 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.45 60.66 4.58 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.239 -0.505 . . . . 1.25 112.819 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.534 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.6 OUTLIER -123.66 -17.08 6.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.586 0.231 . . . . 1.06 111.468 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.05 -3.79 55.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.371 -0.918 . . . . 0.9 113.065 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -136.41 161.45 35.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.696 -0.483 . . . . 1.18 109.696 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.635 HG13 HD13 ' A' ' 125' ' ' ILE . 3.2 m -106.81 115.46 48.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 108.865 -0.791 . . . . 1.08 108.865 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.595 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.2 p30 -88.54 -176.22 5.22 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.851 -0.425 . . . . 0.84 109.851 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.405 ' OH ' ' HG3' ' A' ' 86' ' ' ARG . 18.7 t80 -59.34 -45.88 90.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.755 0.312 . . . . 1.45 111.746 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.28 -42.03 99.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.279 -0.419 . . . . 1.84 111.249 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.595 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 26.4 mt-10 -73.34 -32.17 64.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.68 110.132 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.83 -56.94 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.244 -0.889 . . . . 0.85 110.851 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.55 -33.01 55.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 115.851 -0.613 . . . . 1.23 110.807 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -38.69 90.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 1.96 111.1 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -43.37 26.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.305 -0.407 . . . . 0.89 111.421 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.488 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -66.24 -49.37 67.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.255 -0.429 . . . . 1.14 111.903 -179.178 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.32 31.14 2.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.67 121.14 10.88 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.861 -0.609 . . . . 1.64 111.448 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.497 -0.763 . . . . 3.35 109.569 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.799 0.333 . . . . 2.21 110.531 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 288' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.26 -47.36 82.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 1.57 111.345 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -44.36 -45.1 8.68 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 113.363 0.875 . . . . 1.18 113.363 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 290' ' ' ASN . . . . . 0.484 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.3 p-10 -90.72 -26.99 19.25 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.55 0.574 . . . . 1.07 112.55 -179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 291' ' ' LEU . . . . . 0.531 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -68.93 -45.12 71.61 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 120.172 -0.611 . . . . 1.52 112.624 -178.449 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 292' ' ' TRP . . . . . 0.661 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 89.5 m95 -54.68 -51.5 78.17 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 118.809 0.731 . . . . 0.48 109.739 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 36.0 Cg_exo -62.57 -18.35 63.19 Favored 'Trans proline' 0 C--N 1.363 1.321 0 C-N-CA 121.506 1.471 . . . . 0.61 112.326 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 294' ' ' SER . . . . . 0.603 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 61.6 m -58.74 -60.85 9.08 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 118.374 -0.822 . . . . 0.67 110.414 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 295' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 35.2 Cg_exo -60.94 -29.7 88.54 Favored 'Trans proline' 0 C--N 1.373 1.829 0 CA-C-N 121.359 1.521 . . . . 0.58 110.562 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 296' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 85' ' ' ILE . 7.0 tp -61.14 -44.18 97.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.095 -0.706 . . . . 0.94 109.095 177.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 30.8 ttm -64.91 -35.91 82.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.373 -0.83 . . . . 1.48 109.072 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 298' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 294' ' ' SER . 39.7 mm -61.72 -33.38 57.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.652 -0.703 . . . . 0.7 109.476 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 299' ' ' LYS . . . . . 0.413 ' HE2' ' OE2' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -64.65 -40.29 95.19 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 108.777 -0.823 . . . . 1.21 108.777 178.317 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.8 -44.69 84.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.482 -0.781 . . . . 2.51 109.34 178.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 18.2 m -64.41 -36.31 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.973 -0.558 . . . . 0.81 109.738 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -66.18 -33.38 75.62 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.901 -0.777 . . . . 2.25 108.901 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -69.26 -32.13 71.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 1.76 109.217 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -72.83 -46.09 54.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.472 -0.786 . . . . 1.62 110.009 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 116.396 -0.365 . . . . 1.68 110.029 179.37 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.854 0.359 . . . . 2.82 111.024 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.39 -45.59 90.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 2.61 111.163 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.02 -33.72 72.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 1.78 111.481 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.475 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.6 mt -68.21 -43.09 85.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.013 0.435 . . . . 1.33 110.319 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -64.91 -47.63 77.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.661 -0.7 . . . . 2.26 110.488 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -68.73 -30.01 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.916 -0.583 . . . . 1.91 110.882 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.52 -40.34 82.62 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.479 -0.328 . . . . 1.0 110.676 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.5 -38.96 75.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.034 0.445 . . . . 0.86 110.329 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.1 tpm_? -70.73 -35.5 72.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.911 -0.586 . . . . 1.84 110.526 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.463 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 98.2 t -72.49 -35.18 50.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.092 -0.504 . . . . 1.24 110.76 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -73.45 -39.05 65.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 1.06 110.09 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.677 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 25.5 t0 -80.7 103.87 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.646 -0.706 . . . . 0.95 110.776 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 2.5 mptt -94.63 -28.66 15.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.443 -0.344 . . . . 1.28 111.563 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.631 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.8 OUTLIER -77.32 -21.81 52.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.841 0.353 . . . . 1.36 111.028 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 75.7 57.55 4.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.032 -0.604 . . . . 1.02 113.391 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.44 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 19.8 p-10 -125.88 -1.11 7.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.046 0.451 . . . . 0.86 110.413 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.94 23.96 73.26 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.946 -0.645 . . . . 0.67 112.231 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.44 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 42.2 m-85 -142.8 139.46 30.97 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.188 0.518 . . . . 1.29 111.102 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.547 HG21 HD13 ' A' ' 105' ' ' LEU . 66.7 mt -93.03 99.34 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.113 -0.949 . . . . 0.56 109.705 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.2 t -81.9 163.87 21.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.899 -0.592 . . . . 1.33 110.126 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.38 90.4 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.947 0.403 . . . . 0.75 110.818 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.26 -32.88 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.89 110.993 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -74.49 -41.18 61.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.436 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.66 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.9 tp -65.52 -29.91 70.61 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.392 -0.367 . . . . 0.54 110.124 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.9 mtm180 -57.0 -56.34 23.06 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.149 -0.478 . . . . 2.15 110.107 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 22.0 t-80 -58.08 -35.55 71.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.864 0.364 . . . . 1.21 111.472 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 72.9 t -68.77 -56.97 10.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.3 -0.409 . . . . 0.72 111.743 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.566 ' CE ' ' HA ' ' B' ' 292' ' ' TRP . 0.8 OUTLIER -72.5 -19.73 61.48 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.114 0.783 . . . . 1.6 113.114 -177.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 11.7 p -78.64 -41.79 30.52 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.122 -0.631 . . . . 1.67 110.551 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -67.33 -23.11 65.59 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.378 0.609 . . . . 1.85 109.944 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.51 -35.51 74.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.019 -0.991 . . . . 1.23 110.337 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.01 -65.38 0.56 Allowed Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.667 -0.778 . . . . 1.13 112.211 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -74.9 90.19 2.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.14 0.495 . . . . 2.09 110.75 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -83.02 104.97 13.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 1.92 110.681 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 83.3 mt -91.71 175.4 6.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.11 -0.495 . . . . 1.27 110.23 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 121' ' ' VAL . 40.6 p -76.5 166.34 23.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.703 0.287 . . . . 1.08 111.368 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.46 -37.87 70.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 1.99 110.685 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.28 -44.17 95.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.048 -0.524 . . . . 2.75 110.575 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 124' ' ' MET . 37.8 mt-10 -67.9 -37.31 81.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 1.14 110.336 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.463 ' O ' ' HB2' ' A' ' 124' ' ' MET . 97.6 t -64.98 -41.45 92.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 N-CA-C 109.04 -0.726 . . . . 0.86 109.04 177.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.4 t70 -65.69 -44.26 86.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.87 -0.789 . . . . 1.38 108.87 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 127' ' ' GLU . 19.9 tt0 -53.01 -41.58 64.78 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.446 -0.797 . . . . 1.94 109.704 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.623 ' HG2' ' HB3' ' B' ' 288' ' ' ALA . 57.3 mtp -54.47 -51.0 66.41 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.07 -0.968 . . . . 0.66 110.852 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.852 HG23 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -76.49 -22.49 15.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.251 -0.58 . . . . 0.85 111.002 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 59.3 mtm-85 -65.33 -37.08 85.99 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.35 -0.611 . . . . 1.7 109.35 178.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.532 ' OE1' ' HB2' ' B' ' 289' ' ' ALA . 12.8 pt-20 -92.41 -1.99 56.63 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.057 -0.52 . . . . 1.55 109.988 178.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.599 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -107.55 5.38 26.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.511 0.672 . . . . 0.66 109.682 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 31.9 t70 -115.66 125.51 52.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.11 -0.95 . . . . 0.8 109.708 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.72 -27.12 2.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.186 -0.461 . . . . 1.23 110.791 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.61 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.0 OUTLIER -78.52 -10.34 59.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.282 -0.417 . . . . 1.35 111.072 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.48 62.51 3.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.745 -0.74 . . . . 1.25 112.426 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.644 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.1 OUTLIER -135.1 -17.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.649 0.261 . . . . 1.06 110.81 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 95.93 -14.92 63.97 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.901 -0.666 . . . . 0.9 113.298 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -119.26 169.21 10.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 1.18 110.632 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.852 HG13 HG23 ' A' ' 125' ' ' ILE . 27.0 m -106.09 113.7 43.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.142 0.496 . . . . 1.08 109.87 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.509 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 25.4 p30 -92.21 -177.63 4.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.349 -0.612 . . . . 0.84 109.349 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.92 -57.04 12.45 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.986 0.365 . . . . 1.45 111.986 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -57.45 -46.95 83.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.309 -0.405 . . . . 1.84 111.766 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.509 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 32.7 mt-10 -61.79 -42.92 99.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.795 0.331 . . . . 0.68 110.511 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -59.15 -45.39 91.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.774 -0.648 . . . . 0.85 110.114 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 70.3 t -64.29 -49.94 78.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.427 -0.806 . . . . 1.23 111.689 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -66.69 -38.6 87.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.437 0.532 . . . . 1.96 112.437 -178.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.449 ' HE3' ' HB2' ' A' ' 128' ' ' ALA . 0.1 OUTLIER -70.4 -41.69 72.65 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.746 -0.382 . . . . 0.89 111.589 -179.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.513 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.2 OUTLIER -74.99 -45.92 38.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.016 0.436 . . . . 1.14 111.006 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.43 77.88 1.68 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.205 -0.452 . . . . 1.53 110.749 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -91.72 126.77 36.93 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.123 -0.49 . . . . 1.64 110.721 -179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.24 -0.886 . . . . 3.35 109.784 179.775 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 109.072 -0.714 . . . . 2.21 109.072 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.623 ' HB3' ' HG2' ' A' ' 124' ' ' MET . . . -97.77 0.68 47.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.55 -0.75 . . . . 1.57 112.763 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . 0.532 ' HB2' ' OE1' ' A' ' 127' ' ' GLU . . . -32.23 -50.29 0.22 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.328 0.862 . . . . 1.18 113.328 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.529 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 3.9 p-10 -59.94 -24.29 64.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.64 0.257 . . . . 1.07 111.437 -179.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.589 ' O ' ' HB2' ' B' ' 294' ' ' SER . 5.3 tp -69.52 -25.17 63.9 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 109.332 -0.618 . . . . 1.52 109.332 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.644 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 53.5 m95 -60.88 -56.96 29.93 Favored Pre-proline 0 C--O 1.249 1.045 0 N-CA-C 106.976 -1.49 . . . . 0.48 106.976 176.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.644 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 50.2 Cg_exo -59.17 -17.85 41.08 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 121.268 1.312 . . . . 0.61 112.276 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 43.4 m -56.7 -64.73 2.17 Favored Pre-proline 0 CA--C 1.544 0.713 0 CA-C-O 118.288 -0.863 . . . . 0.67 110.923 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 31.4 Cg_exo -62.24 -26.49 77.53 Favored 'Trans proline' 0 C--N 1.372 1.79 0 CA-C-N 121.889 1.71 . . . . 0.58 110.62 176.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.8 tp -62.12 -44.42 96.67 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.583 0.706 . . . . 0.94 109.158 177.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 34.1 ttm -67.45 -32.88 74.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.26 -0.882 . . . . 1.48 108.923 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.52 HG12 ' O ' ' B' ' 294' ' ' SER . 40.7 mm -65.55 -32.48 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.211 -0.904 . . . . 0.7 109.191 178.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.27 -45.18 94.46 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.89 -0.781 . . . . 1.21 108.89 177.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -66.68 -35.22 79.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.828 -0.624 . . . . 2.51 109.604 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 49.0 m -69.42 -36.74 76.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.81 109.736 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -66.98 -31.22 71.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.679 -0.691 . . . . 2.25 109.42 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -66.43 -42.48 87.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.691 -0.855 . . . . 1.76 108.691 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -67.43 -41.43 84.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.306 -0.861 . . . . 1.62 109.207 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.807 -0.633 . . . . 1.68 109.53 178.656 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.677 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.644 'CA ' ' OD1' ' A' ' 133' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.762 0.315 . . . . 2.82 111.237 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.82 -71.08 0.07 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.534 0.734 . . . . 2.61 112.659 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -63.14 -28.29 69.96 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 111.787 0.291 . . . . 1.78 111.787 -178.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' B' ' 296' ' ' LEU . 0.9 OUTLIER -64.94 -48.0 85.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.23 0.538 . . . . 1.33 109.667 179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -70.6 -44.53 67.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.568 -0.742 . . . . 2.26 110.121 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.405 ' O ' HG23 ' A' ' 91' ' ' VAL . 42.1 mm-40 -61.02 -43.1 99.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.827 -0.624 . . . . 1.91 111.173 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.99 79.5 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.119 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -56.81 -41.37 77.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.627 -0.715 . . . . 0.86 110.64 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -68.13 -36.22 79.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.834 -0.621 . . . . 1.84 111.571 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.543 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 94.3 t -77.88 -35.83 21.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.821 0.343 . . . . 1.24 111.016 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -71.42 -33.14 69.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.504 -0.316 . . . . 1.06 110.813 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.681 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 30.1 t70 -82.9 90.01 6.91 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.607 -0.516 . . . . 0.95 109.607 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 4.6 mptt -91.64 -18.9 23.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 1.28 111.714 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.3 OUTLIER -79.46 -23.92 42.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.874 -0.33 . . . . 1.36 110.549 -179.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 76.5 58.1 3.69 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.845 -0.693 . . . . 1.02 113.127 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.434 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 19.9 p-10 -126.67 -5.62 6.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.867 0.365 . . . . 0.86 110.295 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.96 17.15 77.67 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.847 -0.615 . . . . 0.67 112.751 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -143.89 139.11 29.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.703 0.287 . . . . 1.29 110.577 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.572 ' HB ' HG22 ' A' ' 136' ' ' VAL . 9.8 mt -84.76 103.12 11.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.541 -0.911 . . . . 0.56 108.541 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.506 ' HA ' ' HG2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -82.58 164.02 21.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.655 -0.702 . . . . 1.33 110.367 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -56.46 -44.41 80.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.75 111.044 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -41.33 96.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.045 0.45 . . . . 0.89 110.739 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 108' ' ' VAL . 47.7 mt-10 -67.49 -41.77 83.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.745 -0.662 . . . . 0.86 110.469 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 16.3 tp -67.31 -32.33 73.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.287 -0.415 . . . . 0.54 110.245 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.493 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 30.3 mtm-85 -57.97 -39.44 78.16 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.638 -0.504 . . . . 2.15 109.638 178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -71.31 -33.48 69.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.057 -0.519 . . . . 1.21 110.106 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 104' ' ' GLU . 96.0 t -62.15 -49.15 85.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.09 -0.505 . . . . 0.72 110.07 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.498 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.2 OUTLIER -66.26 -34.0 77.01 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 1.6 110.683 179.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.2 m -64.19 -45.72 87.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.912 0.386 . . . . 1.67 110.22 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -73.98 -24.25 59.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.496 . . . . 1.85 110.26 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' B' ' 294' ' ' SER . 17.8 tp -63.69 -31.77 73.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.673 -0.694 . . . . 1.23 110.302 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.01 -40.17 2.61 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.786 -0.721 . . . . 1.13 112.071 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.68 98.0 5.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 2.09 110.474 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -89.14 100.52 13.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.029 -0.532 . . . . 1.92 110.337 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.84 -174.29 2.5 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.818 -0.628 . . . . 1.27 110.824 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 43.8 p -78.19 165.17 24.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 1.08 110.722 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.493 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 18.9 t70 -63.79 -37.63 88.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.326 -0.397 . . . . 1.99 110.737 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -66.0 -31.85 72.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.134 -0.484 . . . . 2.75 110.386 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -67.38 -37.95 83.95 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.157 -0.683 . . . . 1.14 109.157 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' A' ' 124' ' ' MET . 58.6 t -67.72 -36.33 75.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.638 -0.875 . . . . 0.86 108.638 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -65.87 -43.3 88.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.197 -0.91 . . . . 1.38 108.896 177.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -57.7 -38.84 75.89 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.802 -0.814 . . . . 1.94 108.802 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.692 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 38.8 mtp -58.18 -52.27 66.27 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.177 -0.92 . . . . 0.66 111.276 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.655 HD13 HG13 ' A' ' 136' ' ' VAL . 1.5 mm -68.67 -34.86 67.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 C-N-CA 120.753 -0.379 . . . . 0.85 110.485 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -64.38 -29.65 70.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.947 0.403 . . . . 1.7 110.121 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.52 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 4.5 tt0 -86.14 -27.08 24.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.531 -0.759 . . . . 1.55 110.664 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -89.31 -26.12 21.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.061 -0.518 . . . . 0.66 112.027 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.662 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 30.0 t0 -90.59 109.71 20.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.981 0.419 . . . . 0.8 109.967 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 6.1 mt -100.68 -31.43 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.875 -0.602 . . . . 1.23 111.134 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.61 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -75.56 -20.16 58.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.773 0.321 . . . . 1.35 111.447 -179.034 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.84 61.87 2.33 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.666 -0.778 . . . . 1.25 113.005 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.626 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.5 p-10 -121.72 -14.11 8.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.858 0.361 . . . . 1.06 110.269 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.67 -11.41 61.11 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.076 -0.583 . . . . 0.9 112.632 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HG2' ' HA ' ' A' ' 101' ' ' SER . 16.5 mt-30 -132.29 165.35 24.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.329 0.585 . . . . 1.18 110.853 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.655 HG13 HD13 ' A' ' 125' ' ' ILE . 4.6 m -106.8 124.9 62.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.79 -0.819 . . . . 1.08 108.79 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.557 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.8 p30 -103.54 -178.46 3.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.442 -0.345 . . . . 0.84 110.348 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 142' ' ' VAL . 68.9 t80 -59.2 -44.18 92.23 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 111.914 0.339 . . . . 1.45 111.914 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -61.97 -46.08 90.85 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.698 0.285 . . . . 1.84 111.524 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.557 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 31.7 mt-10 -72.29 -32.24 66.43 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.123 0.487 . . . . 0.68 110.384 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 10.3 t80 -58.89 -52.73 64.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.351 -0.84 . . . . 0.85 111.56 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 138' ' ' TYR . 44.7 t -60.82 -36.48 71.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.488 . . . . 1.23 111.463 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.0 -25.76 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.41 . . . . 1.96 111.912 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.52 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -73.15 -56.46 5.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.075 0.464 . . . . 0.89 110.901 -179.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.555 ' HG2' HD22 ' B' ' 296' ' ' LEU . 2.0 mpt? -68.46 -53.29 24.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.814 -0.63 . . . . 1.14 111.244 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.55 73.77 10.02 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.931 0.396 . . . . 1.53 110.956 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 65.98 6.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 1.64 110.908 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 41.0 mmtt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.697 -0.668 . . . . 3.35 110.287 -179.971 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.572 ' HA ' ' CZ ' ' B' ' 287' ' ' ARG . 4.1 mmp_? . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 109.906 -0.405 . . . . 2.21 109.906 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.692 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -111.17 -28.76 8.14 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.861 0.689 . . . . 1.57 112.861 -178.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.39 -33.95 9.99 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 1.18 112.54 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.4 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 21.5 p-10 -92.1 -30.68 15.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 111.967 0.358 . . . . 1.07 111.967 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.782 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 6.1 tp -72.79 -41.71 64.71 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 113.426 0.899 . . . . 1.52 113.426 -177.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.601 ' CH2' HG21 ' A' ' 136' ' ' VAL . 77.0 m95 -56.61 -50.87 85.36 Favored Pre-proline 0 C--O 1.247 0.954 0 CA-C-N 119.918 1.236 . . . . 0.48 108.989 178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 44.6 Cg_exo -60.53 -21.71 69.44 Favored 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 121.591 1.527 . . . . 0.61 111.877 176.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.496 ' HB2' ' O ' ' B' ' 291' ' ' LEU . 66.6 m -55.84 -65.27 1.6 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-O 118.523 -0.751 . . . . 0.67 110.809 179.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.782 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 13.5 Cg_endo -60.02 -31.21 93.17 Favored 'Trans proline' 0 C--N 1.368 1.589 0 CA-C-N 121.345 1.516 . . . . 0.58 111.665 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.602 HD11 ' HA ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -64.79 -44.79 88.8 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.004 -0.678 . . . . 0.94 109.926 178.47 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 43.4 ttm -69.39 -35.37 75.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.115 -0.698 . . . . 1.48 109.115 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' B' ' 295' ' ' PRO . 22.8 mm -65.62 -30.49 50.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.333 -0.849 . . . . 0.7 109.118 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -68.08 -39.03 82.99 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.076 -0.713 . . . . 1.21 109.076 178.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -65.17 -36.63 84.81 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.264 -1.013 . . . . 2.51 108.264 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 10.9 m -71.55 -32.63 68.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.013 -0.994 . . . . 0.81 109.291 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -69.2 -38.62 78.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.464 -0.939 . . . . 2.25 108.464 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -60.27 -42.43 95.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.307 -0.998 . . . . 1.76 108.307 177.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -62.54 -41.22 98.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 114.922 -1.035 . . . . 1.62 109.086 177.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.292 -0.867 . . . . 1.68 110.263 179.405 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.681 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.662 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.891 0.377 . . . . 2.82 110.583 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -58.35 8.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.864 -0.607 . . . . 2.61 111.495 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -58.46 -31.86 68.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.531 -0.304 . . . . 1.78 111.548 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.559 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.1 mt -66.36 -42.7 91.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.923 0.392 . . . . 1.33 110.479 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -65.1 -41.09 95.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.395 0.617 . . . . 2.26 109.433 178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -68.02 -39.85 83.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.348 -0.842 . . . . 1.91 110.691 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.44 -41.84 77.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.024 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -57.77 -38.76 75.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.072 -0.513 . . . . 0.86 110.818 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -74.71 -40.02 61.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.183 -0.462 . . . . 1.84 111.006 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 94.0 t -67.25 -36.94 78.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.317 -0.401 . . . . 1.24 111.052 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -73.72 -40.03 63.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.297 -0.41 . . . . 1.06 110.192 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.665 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 31.0 t70 -81.98 75.55 8.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.415 0.626 . . . . 0.95 110.175 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -77.74 -21.62 51.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.394 -0.821 . . . . 1.28 111.225 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.638 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.1 OUTLIER -77.97 -13.05 60.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.566 -0.288 . . . . 1.36 110.786 -179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 63.5 63.95 4.1 Favored Glycine 0 C--N 1.333 0.363 0 CA-C-N 115.925 -0.579 . . . . 1.02 112.962 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 99' ' ' TYR . 0.4 OUTLIER -132.57 -8.62 3.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.871 0.367 . . . . 0.86 110.528 -179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.71 15.75 74.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.14 -0.552 . . . . 0.67 113.937 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.595 ' HB2' HD21 ' A' ' 97' ' ' ASN . 94.5 m-85 -144.76 133.62 22.45 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.422 0.611 . . . . 1.29 110.929 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.474 HG21 HD13 ' A' ' 105' ' ' LEU . 33.6 mt -81.99 112.58 20.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.839 -0.618 . . . . 0.56 109.62 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.5 p -95.67 172.97 7.72 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 1.33 110.166 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.88 92.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.659 0.266 . . . . 0.75 110.298 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.03 76.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 0.89 111.092 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.516 ' OE2' ' HA ' ' A' ' 93' ' ' ASP . 49.1 mt-10 -63.01 -36.83 84.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.987 -0.551 . . . . 0.86 111.166 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.571 HD22 ' CD1' ' A' ' 125' ' ' ILE . 7.0 tp -76.73 -34.54 58.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.643 -0.253 . . . . 0.54 111.02 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.413 ' NE ' HG11 ' A' ' 121' ' ' VAL . 36.1 mtt180 -58.81 -37.31 76.12 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.705 -0.48 . . . . 2.15 109.705 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.0 -23.05 65.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.493 -0.776 . . . . 1.21 110.62 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 97.6 t -83.04 -47.35 18.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.929 -0.578 . . . . 0.72 110.564 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.6 mmt -66.27 -30.42 70.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.81 -0.632 . . . . 1.6 112.091 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -41.5 86.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.043 0.449 . . . . 1.67 110.247 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -72.77 -27.76 62.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.763 -0.653 . . . . 1.85 109.555 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.4 tp -63.3 -39.49 94.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.309 -0.859 . . . . 1.23 109.703 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.88 -31.16 4.85 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.63 -0.714 . . . . 1.13 111.608 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.0 93.07 7.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.373 0.606 . . . . 2.09 110.695 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -87.86 95.83 10.25 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.516 -0.766 . . . . 1.92 109.336 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.92 163.57 17.06 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.964 -0.562 . . . . 1.27 111.148 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.7 p -81.24 169.35 17.43 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.836 -0.62 . . . . 1.08 110.05 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -36.03 70.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.875 0.369 . . . . 1.99 110.969 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.0 -46.72 76.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.248 0.547 . . . . 2.75 110.421 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.03 -37.36 83.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.891 -0.595 . . . . 1.14 110.636 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 117' ' ' THR . 69.6 t -63.23 -32.25 55.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 120.954 0.407 . . . . 0.86 110.0 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.5 -53.0 61.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.028 -0.533 . . . . 1.38 109.784 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 126' ' ' ARG . 19.6 tt0 -67.75 -26.79 66.3 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.091 -0.504 . . . . 1.94 110.059 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.758 ' HE3' ' HB3' ' B' ' 291' ' ' LEU . 0.0 OUTLIER -52.87 -53.76 44.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.712 -0.676 . . . . 0.66 110.746 -179.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.571 ' CD1' HD22 ' A' ' 105' ' ' LEU . 1.1 mt -89.36 -18.98 7.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.363 -0.535 . . . . 0.85 110.586 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.441 ' HB3' ' HA ' ' A' ' 123' ' ' GLU . 14.2 ttm180 -65.16 -35.47 81.2 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 108.916 -0.772 . . . . 1.7 108.916 178.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.422 ' HG2' ' HE2' ' A' ' 144' ' ' MET . 7.0 tt0 -74.42 -16.32 60.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.952 -1.022 . . . . 1.55 109.19 178.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -105.03 4.63 31.81 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.19 -0.913 . . . . 0.66 110.594 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.643 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 21.1 t0 -112.36 112.95 24.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.401 0.619 . . . . 0.8 110.331 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mt -106.11 -36.78 3.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.358 -0.837 . . . . 1.23 110.817 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 14.4 p30 -72.42 -29.99 64.22 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.749 0.277 . . . . 1.35 111.749 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 93.46 21.95 27.98 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.543 -0.837 . . . . 1.25 112.367 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.619 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.6 p-10 -89.11 -9.32 51.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.903 0.383 . . . . 1.06 110.716 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.69 -2.74 85.29 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.955 -0.64 . . . . 0.9 112.944 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.577 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 12.6 mt-30 -120.38 169.76 10.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.959 0.409 . . . . 1.18 110.284 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.662 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -116.12 105.29 18.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.466 -0.788 . . . . 1.08 109.309 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.578 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.6 p30 -95.73 175.71 6.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.808 -0.633 . . . . 0.84 109.958 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.443 ' O ' HG23 ' A' ' 142' ' ' VAL . 50.2 t80 -51.61 -45.33 63.17 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.467 0.479 . . . . 1.45 111.624 -178.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -58.79 -50.4 74.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.707 -0.679 . . . . 1.84 112.028 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.578 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 23.6 mt-10 -72.74 -32.8 65.94 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.076 0.465 . . . . 0.68 111.197 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.8 -53.17 59.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.85 112.085 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 138' ' ' TYR . 61.9 t -61.23 -40.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 111.961 0.356 . . . . 1.23 111.961 -178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -67.47 -28.44 67.86 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.197 -0.201 . . . . 1.96 111.485 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.422 ' HE2' ' HG2' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -64.2 -48.94 73.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.142 0.496 . . . . 0.89 110.907 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.728 ' HG2' HD22 ' B' ' 296' ' ' LEU . 1.9 mpt? -77.27 -36.42 54.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.952 -0.567 . . . . 1.14 111.25 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.7 55.92 1.25 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.235 0.541 . . . . 1.53 110.554 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.18 127.89 32.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.478 -0.783 . . . . 1.64 110.605 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.945 -0.57 . . . . 3.35 110.128 179.743 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 110.197 -0.297 . . . . 2.21 110.197 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.503 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -90.23 -30.56 17.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.905 0.383 . . . . 1.57 110.532 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -49.21 -39.0 28.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.202 -0.908 . . . . 1.18 112.686 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.443 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.0 p-10 -88.5 -22.96 23.36 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.013 0.375 . . . . 1.07 112.013 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.758 ' HB3' ' HE3' ' A' ' 124' ' ' MET . 6.9 tp -73.57 -43.27 60.23 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 118.739 -0.648 . . . . 1.52 111.878 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.662 ' CH2' HG21 ' A' ' 136' ' ' VAL . 66.6 m95 -52.96 -52.47 64.89 Favored Pre-proline 0 CA--C 1.552 1.044 0 CA-C-N 119.262 0.937 . . . . 0.48 109.663 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 41.4 Cg_exo -60.33 -23.16 73.65 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.861 1.708 . . . . 0.61 112.028 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 50.9 m -55.93 -64.79 1.93 Allowed Pre-proline 0 CA--C 1.546 0.821 0 CA-C-O 118.355 -0.831 . . . . 0.67 110.834 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 51.5 Cg_exo -57.85 -31.74 93.22 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 121.572 1.597 . . . . 0.58 111.561 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.728 HD22 ' HG2' ' A' ' 145' ' ' MET . 2.6 tp -61.15 -46.16 91.69 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.195 0.522 . . . . 0.94 109.681 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 51.0 ttm -66.99 -39.1 87.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.799 -0.637 . . . . 1.48 109.47 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.523 HG12 ' O ' ' B' ' 294' ' ' SER . 30.7 mm -61.73 -32.43 53.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.734 . . . . 0.7 109.944 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -66.85 -45.97 76.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.06 -0.518 . . . . 1.21 110.246 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.82 -34.22 77.66 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.458 -0.571 . . . . 2.51 109.458 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 15.3 m -70.73 -34.78 72.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.573 -0.739 . . . . 0.81 109.197 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -69.98 -34.89 73.95 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.183 -0.673 . . . . 2.25 109.183 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -63.33 -40.08 96.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.388 -0.968 . . . . 1.76 108.388 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -69.13 -38.18 78.7 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.815 -1.084 . . . . 1.62 109.417 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-N 115.649 -0.705 . . . . 1.68 109.471 178.275 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.665 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.643 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 121.088 0.471 . . . . 2.82 110.862 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -53.93 -49.46 68.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.338 -0.846 . . . . 2.61 111.555 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.54 -44.57 89.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.769 0.318 . . . . 1.78 111.116 -179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.413 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -62.74 -45.91 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 1.33 110.821 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -63.52 -43.91 95.79 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 2.26 110.047 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.444 ' O ' HG23 ' A' ' 91' ' ' VAL . 19.9 mm-40 -64.09 -42.35 96.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 1.91 110.841 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -58.01 -47.95 81.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.306 -0.407 . . . . 1.0 110.146 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -59.85 -38.58 82.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.949 -0.569 . . . . 0.86 110.168 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -65.46 -37.26 86.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 1.84 110.911 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 87' ' ' GLU . 92.3 t -75.96 -35.54 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.089 0.471 . . . . 1.24 110.706 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -71.42 -36.93 71.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 1.06 110.54 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.644 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 28.7 t70 -81.06 84.46 6.5 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.765 -0.457 . . . . 0.95 109.765 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -85.89 -22.8 27.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.563 -0.744 . . . . 1.28 112.142 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.621 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 4.6 p-10 -82.32 -11.0 58.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.977 0.418 . . . . 1.36 110.97 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 65.65 48.04 71.32 Favored Glycine 0 N--CA 1.449 -0.493 0 CA-C-N 115.887 -0.597 . . . . 1.02 113.692 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -115.13 -6.1 12.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.99 0.395 . . . . 0.86 110.536 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 79.54 14.13 81.67 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.944 -0.646 . . . . 0.67 112.722 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -139.16 149.54 44.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.703 0.287 . . . . 1.29 110.747 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.467 ' HB ' HG12 ' A' ' 136' ' ' VAL . 6.0 mt -94.4 103.16 14.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.956 -0.757 . . . . 0.56 108.956 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.4 t -83.56 162.47 20.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.579 -0.737 . . . . 1.33 109.442 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.51 -36.13 73.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.004 0.43 . . . . 0.75 110.399 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.75 -36.92 76.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.933 -0.576 . . . . 0.89 110.555 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.551 ' OE1' ' HA ' ' A' ' 93' ' ' ASP . 45.0 mt-10 -67.64 -40.37 84.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 0.86 110.825 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.571 ' HG ' ' SD ' ' A' ' 109' ' ' MET . 5.0 tp -75.12 -26.03 58.89 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.11 0.481 . . . . 0.54 110.258 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 mtm-85 -68.09 -13.86 62.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.238 -0.653 . . . . 2.15 109.238 178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -106.33 15.78 25.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.083 -0.962 . . . . 1.21 109.024 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 104' ' ' GLU . 74.7 t -120.04 -54.92 3.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.445 -0.798 . . . . 0.72 109.622 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.571 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.1 OUTLIER -69.0 -12.39 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.381 -0.827 . . . . 1.6 111.301 -179.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -72.55 -37.34 68.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.159 -0.682 . . . . 1.67 109.159 178.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -79.03 -16.74 56.44 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.953 -1.021 . . . . 1.85 109.115 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 109' ' ' MET . 45.5 tp -67.04 -17.24 64.81 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.06 -0.973 . . . . 1.23 109.825 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 104.29 -70.52 0.26 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.667 -0.697 . . . . 1.13 112.128 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -61.78 106.33 0.67 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.989 0.423 . . . . 2.09 111.158 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -100.29 91.45 4.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.023 -0.535 . . . . 1.92 109.795 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 32.2 mt -77.33 178.84 6.81 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.281 -0.872 . . . . 1.27 111.105 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 23.1 p -77.8 172.28 13.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.349 . . . . 1.08 111.699 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -56.09 -48.57 75.88 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.093 -0.503 . . . . 1.99 111.802 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -64.49 -35.06 79.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 2.75 111.055 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.81 -39.61 79.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.884 0.373 . . . . 1.14 110.081 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 124' ' ' MET . 90.8 t -68.65 -36.89 76.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.975 -0.75 . . . . 0.86 108.975 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 4.0 t70 -63.21 -47.71 81.37 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.454 -0.943 . . . . 1.38 108.454 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.592 ' HG2' ' NH2' ' A' ' 126' ' ' ARG . 0.0 OUTLIER -56.49 -37.3 70.2 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.388 -0.824 . . . . 1.94 109.948 178.55 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.605 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 2.5 mtp -55.43 -50.26 70.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.278 -0.874 . . . . 0.66 111.29 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.578 HG23 HG23 ' A' ' 136' ' ' VAL . 0.9 OUTLIER -79.49 -27.01 12.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.124 -0.63 . . . . 0.85 110.946 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.592 ' NH2' ' HG2' ' A' ' 123' ' ' GLU . 80.1 mtm-85 -63.84 -31.35 72.5 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 108.273 -1.01 . . . . 1.7 108.273 177.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -72.78 -29.38 63.25 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 114.861 -1.063 . . . . 1.55 109.459 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -94.42 -0.24 54.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.415 -0.812 . . . . 0.66 111.528 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 20.7 t0 -106.9 116.41 31.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.265 0.555 . . . . 0.8 110.5 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.4 mt -109.51 -32.15 2.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.779 -0.646 . . . . 1.23 110.725 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 9.3 p30 -77.79 -14.93 59.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.883 0.373 . . . . 1.35 110.826 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.2 30.87 64.48 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.039 -0.601 . . . . 1.25 112.259 179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.615 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -89.67 -10.83 44.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.014 0.435 . . . . 1.06 110.378 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.06 -12.57 68.72 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.141 -0.552 . . . . 0.9 112.753 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.429 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 6.1 mt-30 -120.67 173.08 7.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 1.18 110.929 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.635 HG21 ' CH2' ' B' ' 292' ' ' TRP . 2.1 t -115.86 105.92 19.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.673 -0.694 . . . . 1.08 109.752 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.539 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 2.2 p30 -90.3 173.09 8.32 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.363 -0.381 . . . . 0.84 110.039 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -52.37 -44.89 65.51 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.308 0.38 . . . . 1.45 111.623 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -57.2 -55.11 38.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.008 -0.542 . . . . 1.84 111.199 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.539 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 33.8 mt-10 -64.72 -42.75 95.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.327 -0.397 . . . . 0.68 110.565 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -53.51 -58.0 8.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.647 -0.706 . . . . 0.85 111.436 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 65.1 t -65.81 -51.95 55.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.069 -0.514 . . . . 1.23 111.953 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -56.65 -42.82 79.6 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.724 0.638 . . . . 1.96 112.724 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -41.3 96.71 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.945 0.35 . . . . 0.89 111.945 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.504 ' SD ' HD22 ' B' ' 296' ' ' LEU . 10.1 mtt -81.25 -31.02 33.96 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.412 -0.358 . . . . 1.14 111.351 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 3.2 m -87.98 59.9 5.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.429 0.633 . . . . 1.53 110.596 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.83 137.14 36.2 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.448 -0.796 . . . . 1.64 110.237 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.094 -0.955 . . . . 3.35 109.974 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? . . . . . 0 N--CA 1.481 1.088 0 N-CA-C 109.92 -0.4 . . . . 2.21 109.92 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -116.9 -15.01 10.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.15 -0.477 . . . . 1.57 110.8 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -59.46 -18.84 43.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.399 -0.819 . . . . 1.18 112.594 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.422 ' ND2' HD12 ' B' ' 291' ' ' LEU . 13.7 p-10 -91.11 -32.03 16.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-O 120.822 0.344 . . . . 1.07 111.527 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.477 ' O ' ' CD ' ' B' ' 295' ' ' PRO . 8.8 mp -70.09 -42.58 72.54 Favored 'General case' 0 C--O 1.213 -0.824 0 CA-C-O 118.937 -0.554 . . . . 1.52 111.441 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.635 ' CH2' HG21 ' A' ' 136' ' ' VAL . 65.5 m95 -53.48 -54.63 43.47 Favored Pre-proline 0 CA--C 1.555 1.165 0 CA-C-N 118.915 0.779 . . . . 0.48 110.387 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.623 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 43.6 Cg_exo -60.75 -20.11 64.32 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.822 1.681 . . . . 0.61 112.229 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.589 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 73.9 m -58.5 -64.2 3.13 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.987 -1.006 . . . . 0.67 110.116 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 75.9 Cg_exo -54.57 -31.77 71.44 Favored 'Trans proline' 0 C--N 1.372 1.801 0 CA-C-N 121.978 1.742 . . . . 0.58 111.374 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.504 HD22 ' SD ' ' A' ' 145' ' ' MET . 6.0 tp -61.62 -48.11 82.36 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.592 0.711 . . . . 0.94 109.5 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 32.9 ttm -67.73 -30.21 69.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.625 -0.716 . . . . 1.48 109.232 178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.564 HG12 ' O ' ' B' ' 294' ' ' SER . 40.2 mm -68.36 -28.72 41.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 108.886 -0.783 . . . . 0.7 108.886 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -39.95 92.0 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.992 -1.114 . . . . 1.21 107.992 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -66.2 -40.22 90.24 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.454 -0.794 . . . . 2.51 109.093 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 7.2 m -68.39 -36.22 78.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.407 -0.815 . . . . 0.81 109.551 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -69.47 -34.7 74.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.497 -0.774 . . . . 2.25 109.36 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -33.49 75.44 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.572 -0.899 . . . . 1.76 108.572 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -72.38 -46.56 54.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.301 -0.863 . . . . 1.62 109.498 178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 89.6 p . . . . . 0 N--CA 1.456 -0.145 0 CA-C-N 116.071 -0.513 . . . . 1.68 109.914 179.056 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.644 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.655 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.722 0.296 . . . . 2.82 110.472 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -63.48 -48.39 77.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.562 -0.29 . . . . 2.61 111.619 -178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.28 -43.07 92.56 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.771 0.286 . . . . 1.78 111.771 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 mt -66.2 -43.63 91.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.832 0.348 . . . . 1.33 110.796 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 86' ' ' ARG . 38.5 ttt-85 -62.62 -42.26 99.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.003 -0.544 . . . . 2.26 110.642 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.434 ' O ' HG23 ' A' ' 91' ' ' VAL . 70.9 tt0 -75.23 -33.09 61.3 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 1.91 111.167 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.61 -45.35 81.51 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 120.824 0.345 . . . . 1.0 110.427 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -60.56 -39.13 86.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.883 -0.599 . . . . 0.86 110.436 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.435 ' NH2' ' HA2' ' A' ' 96' ' ' GLY . 6.8 tpm_? -67.63 -31.32 71.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.014 -0.539 . . . . 1.84 110.771 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 87' ' ' GLU . 94.1 t -78.53 -42.96 26.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 1.24 111.239 179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -68.08 -40.76 82.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 1.06 110.91 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.67 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 32.5 t70 -79.78 76.93 6.44 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.044 -0.724 . . . . 0.95 109.044 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -71.07 -28.54 64.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.225 -0.898 . . . . 1.28 111.441 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.645 ' OD2' 'CA ' ' A' 1000 ' ' ' CA' . 0.0 OUTLIER -70.11 -24.17 63.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.78 -0.368 . . . . 1.36 110.473 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.435 ' HA2' ' NH2' ' A' ' 90' ' ' ARG . . . 71.3 58.42 5.54 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.063 -0.589 . . . . 1.02 113.856 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.448 ' HB3' ' OD1' ' A' ' 95' ' ' ASP . 14.9 p-10 -128.72 -8.12 5.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.234 0.54 . . . . 0.86 110.677 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.36 13.46 65.65 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.553 -0.832 . . . . 0.67 112.151 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.583 ' CE1' ' HB3' ' A' ' 137' ' ' ASN . 40.2 m-85 -140.38 124.87 17.89 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.586 0.232 . . . . 1.29 110.611 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.592 HG21 HD13 ' A' ' 105' ' ' LEU . 8.0 mt -79.03 102.79 5.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 108.917 -0.772 . . . . 0.56 108.917 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.3 m -77.55 161.95 27.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.51 -0.768 . . . . 1.33 110.408 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.95 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.422 . . . . 0.75 110.522 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.51 -30.81 71.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 0.89 111.132 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -75.99 -41.56 50.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.106 -0.497 . . . . 0.86 110.388 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.592 HD13 HG21 ' A' ' 100' ' ' ILE . 5.5 tp -74.63 -31.64 62.05 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.199 -0.455 . . . . 0.54 111.191 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.465 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 50.3 mtm-85 -57.16 -35.62 69.77 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.224 0.535 . . . . 2.15 110.041 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -69.53 -36.92 76.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.766 -0.652 . . . . 1.21 109.319 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.0 t -66.31 -41.15 88.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.427 -0.806 . . . . 0.72 109.792 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.38 -27.12 69.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.062 0.458 . . . . 1.6 110.604 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 21.7 m -71.49 -35.11 70.68 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.317 0.579 . . . . 1.67 109.565 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -88.09 -3.04 58.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.659 -0.701 . . . . 1.85 109.856 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 22.8 tp -85.79 -0.49 55.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.296 -0.866 . . . . 1.23 110.13 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 85.31 -62.81 4.43 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.714 -0.675 . . . . 1.13 111.724 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -74.64 96.13 2.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.987 0.423 . . . . 2.09 110.615 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -81.02 99.35 8.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 1.92 109.917 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 23.7 mt -90.53 167.1 12.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.606 -0.725 . . . . 1.27 110.668 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 121' ' ' VAL . 41.4 p -73.06 166.19 23.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.347 -0.388 . . . . 1.08 110.909 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.465 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 27.9 t0 -57.91 -43.06 85.94 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.511 0.189 . . . . 1.99 111.511 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -62.45 -35.32 78.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.667 0.27 . . . . 2.75 110.546 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -69.36 -38.64 78.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.779 -0.452 . . . . 1.14 109.779 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 117' ' ' THR . 55.5 t -68.26 -36.88 76.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 108.907 -0.775 . . . . 0.86 108.907 178.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -64.02 -42.65 97.06 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.897 -0.779 . . . . 1.38 108.897 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -63.53 -34.51 77.95 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.252 -0.885 . . . . 1.94 109.186 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.754 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 4.8 mtp -61.21 -50.1 74.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.432 -0.804 . . . . 0.66 110.683 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.755 HG23 HG13 ' A' ' 136' ' ' VAL . 0.7 OUTLIER -75.43 -24.38 17.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 120.771 -0.372 . . . . 0.85 110.388 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -66.78 -29.46 69.41 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.657 -0.868 . . . . 1.7 108.657 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -82.76 -20.7 35.39 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.826 -1.079 . . . . 1.55 109.558 178.513 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 144' ' ' MET . . . -99.91 -2.36 34.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.666 -0.697 . . . . 0.66 111.363 -179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.654 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 29.0 t70 -106.47 112.15 25.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.147 -0.479 . . . . 0.8 109.794 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.9 mt -107.68 -22.47 4.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.229 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.62 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 3.2 p-10 -85.39 -13.43 49.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.808 0.337 . . . . 1.35 111.677 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.01 45.08 12.22 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.94 -0.648 . . . . 1.25 113.559 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.643 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.4 OUTLIER -112.45 -13.52 13.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.008 0.433 . . . . 1.06 110.301 179.369 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.47 -36.92 3.96 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.801 -0.714 . . . . 0.9 112.745 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -107.67 172.3 6.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.066 0.46 . . . . 1.18 110.894 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.755 HG13 HG23 ' A' ' 125' ' ' ILE . 17.0 m -107.73 118.59 55.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 109.206 -0.664 . . . . 1.08 109.206 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.583 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.1 p30 -92.83 177.2 6.16 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.669 -0.493 . . . . 0.84 109.669 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -50.19 -49.1 53.58 Favored 'General case' 0 C--N 1.329 -0.305 0 O-C-N 123.192 0.308 . . . . 1.45 111.783 -179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.91 -54.98 41.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 1.84 111.257 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.0 -42.73 98.98 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.391 -0.368 . . . . 0.68 111.007 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -53.54 -55.28 26.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.69 -0.686 . . . . 0.85 111.121 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 56.2 t -69.98 -41.1 79.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.979 -0.555 . . . . 1.23 111.892 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.76 -43.99 87.2 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.517 0.562 . . . . 1.96 112.517 -178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 128' ' ' ALA . 1.4 tmt? -67.28 -45.24 77.2 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.862 0.319 . . . . 0.89 111.862 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.434 ' SD ' HD13 ' B' ' 296' ' ' LEU . 29.5 mtt -72.85 -50.89 21.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.235 -0.438 . . . . 1.14 111.844 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.6 m -90.01 50.47 1.88 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.46 0.648 . . . . 1.53 111.158 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -92.02 66.06 4.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.75 -0.659 . . . . 1.64 110.301 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.251 -0.881 . . . . 3.35 109.747 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.022 -0.362 . . . . 2.21 110.022 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.754 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -46.33 -40.51 11.92 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.604 0.565 . . . . 1.57 112.215 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -47.6 -45.4 27.46 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.837 0.711 . . . . 1.18 112.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -91.56 -22.71 20.2 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 112.307 0.484 . . . . 1.07 112.307 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.471 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 0.1 OUTLIER -68.76 -55.5 11.08 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 118.668 -0.682 . . . . 1.52 112.067 -178.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.605 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 84.0 m95 -49.1 -52.48 47.39 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 118.867 0.758 . . . . 0.48 110.869 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 57.6 Cg_exo -56.69 -28.47 75.66 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 122.035 1.823 . . . . 0.61 112.901 178.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.551 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 38.1 m -56.35 -62.72 4.35 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-O 118.358 -0.83 . . . . 0.67 110.915 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 64.8 Cg_exo -55.14 -31.63 76.39 Favored 'Trans proline' 0 C--N 1.369 1.645 0 CA-C-N 121.297 1.499 . . . . 0.58 111.677 176.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.434 HD13 ' SD ' ' A' ' 145' ' ' MET . 10.4 tp -64.82 -42.88 94.62 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.546 0.689 . . . . 0.94 109.487 178.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 46.0 ttm -66.25 -31.04 71.61 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.399 -0.963 . . . . 1.48 108.399 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 294' ' ' SER . 38.6 mm -64.85 -30.51 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-N 115.135 -0.939 . . . . 0.7 109.537 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -39.05 87.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 108.235 -1.024 . . . . 1.21 108.235 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -61.38 -43.53 98.71 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.336 -0.987 . . . . 2.51 108.336 177.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.6 m -67.12 -34.69 78.13 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.81 110.133 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 302' ' ' LYS . 25.5 tptt -68.78 -32.27 71.88 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.467 -0.568 . . . . 2.25 109.467 178.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -63.92 -36.46 84.03 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 107.747 -1.205 . . . . 1.76 107.747 177.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -66.63 -39.64 88.38 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.628 -1.169 . . . . 1.62 108.77 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 C--O 1.231 0.129 0 CA-C-N 115.731 -0.668 . . . . 1.68 109.946 178.584 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.67 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.654 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 120.794 0.33 . . . . 2.82 110.772 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.39 -39.36 85.6 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.401 -0.363 . . . . 2.61 111.639 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.21 -43.73 83.04 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.024 0.44 . . . . 1.78 109.961 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 mt -68.39 -46.2 81.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.496 -0.775 . . . . 1.33 110.983 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -63.25 -44.64 94.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.739 0.304 . . . . 2.26 110.773 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 91' ' ' VAL . 30.7 tt0 -65.03 -40.6 95.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.092 -0.504 . . . . 1.91 110.149 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.74 -46.68 81.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -58.08 -42.7 86.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.628 -0.715 . . . . 0.86 110.33 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -65.34 -42.97 92.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.838 -0.619 . . . . 1.84 111.162 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.523 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 89.8 t -68.33 -34.51 66.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.177 -0.465 . . . . 1.24 110.866 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.71 -38.16 64.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.33 -0.396 . . . . 1.06 110.126 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.655 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 32.0 t70 -82.48 81.59 8.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.362 0.601 . . . . 0.95 109.88 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 8.6 mttt -81.73 -15.9 52.89 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.507 -0.769 . . . . 1.28 111.766 -178.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.2 OUTLIER -81.77 -26.74 34.19 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.603 -0.439 . . . . 1.36 110.473 -179.425 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.46 23.39 40.13 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.805 -0.712 . . . . 1.02 114.848 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.428 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 12.7 p-10 -96.92 -8.51 30.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.781 0.791 . . . . 0.86 111.127 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.05 20.8 66.8 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.772 -0.728 . . . . 0.67 112.334 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -144.62 130.67 19.43 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.888 -0.412 . . . . 1.29 109.888 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.597 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 65.7 mt -76.44 102.21 3.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.163 -0.68 . . . . 0.56 109.163 178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -81.27 165.72 21.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.12 -0.491 . . . . 1.33 109.692 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.59 68.3 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.802 0.334 . . . . 0.75 111.283 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -70.77 -42.41 70.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.072 0.463 . . . . 0.89 110.199 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 108' ' ' VAL . 41.4 mt-10 -70.16 -37.06 75.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.556 -0.747 . . . . 0.86 110.304 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.679 HD22 HG12 ' A' ' 125' ' ' ILE . 19.2 tp -67.88 -29.39 68.48 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.329 0.585 . . . . 0.54 109.782 178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -76.91 5.11 8.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.461 -0.79 . . . . 2.15 109.926 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -125.31 16.2 8.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.303 -0.862 . . . . 1.21 109.066 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 104' ' ' GLU . 94.0 t -120.59 -66.87 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.633 -0.712 . . . . 0.72 110.535 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.478 ' HG2' ' SD ' ' A' ' 124' ' ' MET . 0.8 OUTLIER -67.77 -18.88 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.672 -0.695 . . . . 1.6 111.323 -178.788 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -45.88 51.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.653 0.74 . . . . 1.67 109.383 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.87 -25.29 65.45 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 114.972 -1.013 . . . . 1.85 109.389 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.472 HD22 ' HD3' ' B' ' 295' ' ' PRO . 11.6 tp -60.28 -25.59 65.83 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.865 -1.061 . . . . 1.23 110.554 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.98 -35.18 4.28 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.921 -0.657 . . . . 1.13 111.903 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -66.91 102.64 0.99 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.0 0.429 . . . . 2.09 111.001 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 28.5 mttp -85.2 85.51 7.46 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.897 -0.592 . . . . 1.92 109.901 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.425 HD11 HD22 ' B' ' 291' ' ' LEU . 73.0 mt -95.57 162.61 13.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.577 -0.738 . . . . 1.27 111.45 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 22.3 p -87.14 170.56 11.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.352 -0.84 . . . . 1.08 110.524 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -55.94 -42.7 76.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 1.99 110.921 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.55 -39.89 92.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.288 -0.415 . . . . 2.75 110.753 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -68.87 -37.23 78.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.851 0.358 . . . . 1.14 110.248 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 124' ' ' MET . 56.1 t -67.19 -36.24 76.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.8 -0.815 . . . . 0.86 108.8 177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 23.5 t70 -63.59 -43.12 97.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.34 -0.846 . . . . 1.38 109.395 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -63.11 -34.69 78.16 Favored 'General case' 0 CA--C 1.52 -0.188 0 N-CA-C 109.406 -0.59 . . . . 1.94 109.406 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.689 ' HA ' ' CB ' ' B' ' 288' ' ' ALA . 5.6 mtp -60.07 -50.77 72.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.565 -0.743 . . . . 0.66 110.499 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.967 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -75.45 -22.81 16.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.664 -0.414 . . . . 0.85 110.197 179.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.422 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 10.2 ttm180 -67.05 -23.6 65.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.289 -0.634 . . . . 1.7 109.289 177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -92.55 -19.39 22.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.036 -0.984 . . . . 1.55 110.729 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -97.44 -41.22 8.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.893 0.331 . . . . 0.66 111.893 -179.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.645 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 19.6 t0 -79.87 106.99 12.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.22 0.534 . . . . 0.8 110.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -99.64 -34.09 4.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.565 -0.743 . . . . 1.23 110.972 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -74.55 -23.59 58.81 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.631 0.253 . . . . 1.35 111.242 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.04 29.4 34.31 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.77 -0.729 . . . . 1.25 112.743 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.632 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.4 p-10 -84.92 -20.3 30.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.901 0.381 . . . . 1.06 110.32 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.03 -7.9 59.04 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 121.031 -0.604 . . . . 0.9 112.943 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -128.26 163.71 24.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.392 0.615 . . . . 1.18 110.957 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.967 HG22 HD11 ' A' ' 125' ' ' ILE . 0.1 OUTLIER -99.73 101.15 11.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.188 -0.915 . . . . 1.08 108.826 178.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -86.34 171.61 11.06 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.768 -0.373 . . . . 0.84 110.579 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -51.71 -50.41 60.57 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 123.498 0.499 . . . . 1.45 111.957 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.67 -55.03 39.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.604 -0.271 . . . . 1.84 111.463 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.55 -43.45 97.21 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.816 0.341 . . . . 0.68 110.547 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -55.03 -54.26 45.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.603 -0.726 . . . . 0.85 111.178 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 89.9 t -70.16 -43.89 78.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.876 -0.602 . . . . 1.23 112.045 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -63.35 -44.0 96.09 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.333 0.494 . . . . 1.96 112.333 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.75 72.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.804 0.298 . . . . 0.89 111.804 -178.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.537 ' SD ' HD13 ' B' ' 296' ' ' LEU . 34.9 mtt -71.95 -47.7 50.46 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.993 0.368 . . . . 1.14 111.993 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.79 47.62 1.52 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.379 0.609 . . . . 1.53 110.527 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.59 130.27 41.96 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.424 -0.807 . . . . 1.64 110.268 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.188 -0.911 . . . . 3.35 109.843 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.854 0.359 . . . . 2.21 110.42 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.689 ' CB ' ' HA ' ' A' ' 124' ' ' MET . . . -134.84 -10.29 2.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 1.57 111.168 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -56.39 -21.94 28.18 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 115.754 -0.657 . . . . 1.18 112.092 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.435 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 12.5 p-10 -92.0 -29.45 16.6 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.038 0.447 . . . . 1.07 111.315 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.567 ' O ' ' HB2' ' B' ' 294' ' ' SER . 0.2 OUTLIER -72.21 -41.24 67.14 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-O 118.552 -0.737 . . . . 1.52 112.946 -177.685 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.647 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 66.0 m95 -57.73 -50.7 86.67 Favored Pre-proline 0 C--O 1.246 0.882 0 CA-C-N 119.546 1.066 . . . . 0.48 109.179 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 52.3 Cg_exo -58.34 -21.24 51.99 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.481 1.454 . . . . 0.61 111.735 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.57 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 69.4 m -57.63 -63.47 3.75 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-O 118.08 -0.962 . . . . 0.67 110.102 178.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.604 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 74.3 Cg_exo -55.72 -29.95 73.59 Favored 'Trans proline' 0 C--N 1.376 2.009 0 CA-C-N 121.815 1.684 . . . . 0.58 111.361 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.537 HD13 ' SD ' ' A' ' 145' ' ' MET . 5.1 tp -65.25 -44.18 88.97 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.328 0.585 . . . . 0.94 109.763 178.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 69.2 mtm -68.17 -31.23 70.63 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.235 -1.024 . . . . 1.48 108.235 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.495 HG12 ' O ' ' B' ' 294' ' ' SER . 38.1 mm -66.84 -28.94 44.69 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 N-CA-C 108.752 -0.833 . . . . 0.7 108.752 177.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -42.41 93.06 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.565 -0.902 . . . . 1.21 108.565 177.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -70.53 -35.76 73.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.632 -0.713 . . . . 2.51 109.507 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 13.6 m -67.52 -44.9 77.27 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 109.407 -0.59 . . . . 0.81 109.407 178.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' B' ' 298' ' ' ILE . 0.1 OUTLIER -64.22 -36.24 83.43 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.592 -0.731 . . . . 2.25 109.237 179.008 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 23.6 tttp -58.12 -44.31 87.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.644 -0.707 . . . . 1.76 109.462 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -68.59 -44.92 73.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.422 -0.808 . . . . 1.62 109.982 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 51.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 1.68 110.538 179.358 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.655 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.645 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 120.619 0.247 . . . . 2.82 111.52 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 1.5 mp0 -61.73 -55.35 31.24 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.819 0.343 . . . . 2.61 110.846 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -60.2 -34.66 73.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.122 -0.49 . . . . 1.78 110.502 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.544 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.5 mt -65.4 -46.73 89.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.989 -0.55 . . . . 1.33 110.829 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -59.09 -44.22 91.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.108 -0.496 . . . . 2.26 110.576 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.433 ' CD ' ' HZ1' ' B' ' 299' ' ' LYS . 1.0 OUTLIER -73.12 -31.77 64.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.193 -0.458 . . . . 1.91 110.813 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.73 80.75 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.136 0.493 . . . . 1.0 109.982 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -62.02 -38.72 89.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.241 -0.89 . . . . 0.86 110.163 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -71.86 -27.8 63.12 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.79 -0.641 . . . . 1.84 110.838 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 92.8 t -83.13 -45.04 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.378 -0.373 . . . . 1.24 111.258 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.5 m-30 -66.69 -32.64 74.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.3 -0.409 . . . . 1.06 110.994 -179.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.663 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 25.9 t0 -83.73 91.42 7.49 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.91 -0.774 . . . . 0.95 108.91 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 mptt -85.27 -33.28 22.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.831 -0.622 . . . . 1.28 112.116 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.634 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.8 OUTLIER -69.14 -29.27 67.27 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.678 -0.409 . . . . 1.36 110.293 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.86 28.28 26.62 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.011 -0.614 . . . . 1.02 114.267 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.467 HD21 ' HB2' ' A' ' 99' ' ' TYR . 20.0 p-10 -90.8 -8.22 50.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 117.729 0.764 . . . . 0.86 110.781 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.0 17.5 61.15 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.831 -0.699 . . . . 0.67 111.728 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HB2' HD21 ' A' ' 97' ' ' ASN . 98.6 m-85 -144.54 145.32 31.77 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.76 0.314 . . . . 1.29 110.346 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.606 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 38.1 mt -90.85 100.81 11.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 115.954 -0.566 . . . . 0.56 109.65 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -79.35 163.19 25.06 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.968 -0.56 . . . . 1.33 110.442 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.02 -43.01 81.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 0.75 110.093 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.08 91.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.871 -0.604 . . . . 0.89 110.839 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.429 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.5 mt-10 -69.46 -37.83 77.49 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.537 -0.756 . . . . 0.86 111.036 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.603 HD22 ' CD1' ' A' ' 125' ' ' ILE . 10.1 tp -72.92 -29.79 63.4 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.766 0.317 . . . . 0.54 110.4 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.475 ' HD3' ' OD1' ' A' ' 118' ' ' ASP . 31.0 mtm-85 -61.31 -32.68 72.54 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.013 0.435 . . . . 2.15 110.306 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -82.26 -6.45 59.24 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.495 0.664 . . . . 1.21 110.686 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 104' ' ' GLU . 85.6 t -92.54 -51.82 10.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.902 -0.59 . . . . 0.72 110.288 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.544 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -69.22 -16.91 63.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.756 -0.656 . . . . 1.6 112.151 -178.69 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.432 ' HA ' ' HG2' ' A' ' 115' ' ' LYS . 0.4 OUTLIER -72.1 -35.84 69.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.934 0.397 . . . . 1.67 109.969 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -76.54 -20.47 56.84 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.675 -0.693 . . . . 1.85 109.864 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.59 HD11 ' HB3' ' B' ' 294' ' ' SER . 59.3 tp -71.96 -10.75 60.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.219 -0.901 . . . . 1.23 110.508 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 92.62 -42.72 2.66 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.797 -0.716 . . . . 1.13 111.342 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.02 75.69 5.52 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 2.09 110.148 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 110' ' ' THR . 57.3 mttp -73.66 113.02 10.31 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.441 -0.8 . . . . 1.92 110.545 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.97 179.85 4.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.912 -0.586 . . . . 1.27 110.06 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.3 p -87.32 171.09 10.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.475 -0.33 . . . . 1.08 110.845 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.475 ' OD1' ' HD3' ' A' ' 106' ' ' ARG . 25.1 t0 -59.19 -42.39 90.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.327 -0.397 . . . . 1.99 111.443 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.11 -42.4 99.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.751 0.31 . . . . 2.75 110.534 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -65.02 -37.79 88.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 1.14 110.326 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 124' ' ' MET . 61.9 t -69.47 -40.86 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.724 -0.473 . . . . 0.86 109.724 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.47 -40.03 94.93 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.502 -0.555 . . . . 1.38 109.502 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -64.78 -34.0 77.31 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 109.161 -0.681 . . . . 1.94 109.161 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.676 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 8.0 mtp -60.87 -45.92 92.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.758 -0.655 . . . . 0.66 110.006 178.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.827 HG23 HG13 ' A' ' 136' ' ' VAL . 0.4 OUTLIER -77.79 -19.78 13.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.593 -0.443 . . . . 0.85 109.832 179.14 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -68.99 -30.25 68.62 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.11 -1.07 . . . . 1.7 108.11 177.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -88.36 -11.19 46.96 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.422 -1.263 . . . . 1.55 109.206 178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -109.23 1.27 20.12 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.594 -0.73 . . . . 0.66 112.11 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.64 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 26.0 t0 -115.17 129.06 56.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.633 -0.506 . . . . 0.8 109.633 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.93 -33.59 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.255 -0.43 . . . . 1.23 111.132 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.639 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.4 p-10 -69.96 -25.3 63.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.874 0.369 . . . . 1.35 111.11 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 88.49 64.84 1.32 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.467 -0.873 . . . . 1.25 111.795 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.632 ' OD2' 'CA ' ' A' 1001 ' ' ' CA' . 0.7 OUTLIER -131.45 -18.27 2.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.679 0.276 . . . . 1.06 110.793 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.47 -25.86 26.74 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.577 -0.82 . . . . 0.9 113.065 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -116.44 176.1 5.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 1.18 110.216 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.827 HG13 HG23 ' A' ' 125' ' ' ILE . 30.0 m -106.82 122.01 60.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 1.08 108.692 178.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.406 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 28.7 p30 -94.57 -177.99 4.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.426 -0.352 . . . . 0.84 110.17 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -55.92 -49.25 73.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.793 0.33 . . . . 1.45 111.694 -178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -60.73 -54.09 49.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.106 -0.497 . . . . 1.84 111.632 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.406 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 41.2 mt-10 -61.76 -39.69 92.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.341 -0.39 . . . . 0.68 111.758 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 137' ' ' ASN . 11.3 t80 -56.39 -58.62 7.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.973 -0.558 . . . . 0.85 111.376 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 22.6 t -65.87 -37.06 79.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.224 -0.443 . . . . 1.23 111.366 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -62.54 -44.18 96.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.143 -0.48 . . . . 1.96 111.582 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -45.14 65.55 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.883 0.373 . . . . 0.89 110.796 -179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.47 ' CG ' HD22 ' B' ' 296' ' ' LEU . 0.2 OUTLIER -62.42 -39.3 92.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.098 -0.501 . . . . 1.14 111.659 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.57 37.52 2.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.104 0.478 . . . . 1.53 110.776 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -84.92 81.7 8.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.151 -0.477 . . . . 1.64 111.006 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.389 -0.815 . . . . 3.35 109.538 179.489 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.821 0.343 . . . . 2.21 110.591 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.676 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.96 -41.77 97.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 1.57 111.566 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -45.77 -41.83 11.32 Favored 'General case' 0 C--O 1.223 -0.335 0 O-C-N 123.966 0.791 . . . . 1.18 113.032 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -90.73 -27.93 18.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.876 -0.33 . . . . 1.07 111.885 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' B' ' 294' ' ' SER . 2.5 tp -73.53 -44.85 56.65 Favored 'General case' 0 C--O 1.219 -0.548 0 N-CA-C 113.004 0.742 . . . . 1.52 113.004 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.612 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 69.1 m95 -54.26 -53.66 56.58 Favored Pre-proline 0 CA--C 1.551 1.004 0 CA-C-N 119.534 1.061 . . . . 0.48 109.526 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 42.9 Cg_exo -61.35 -20.82 69.87 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 121.637 1.558 . . . . 0.61 112.428 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 43.4 m -55.97 -64.79 1.95 Allowed Pre-proline 0 CA--C 1.544 0.73 0 CA-C-O 118.381 -0.819 . . . . 0.67 110.375 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' B' ' 294' ' ' SER . 46.0 Cg_exo -59.24 -31.23 94.83 Favored 'Trans proline' 0 C--N 1.37 1.689 0 CA-C-N 121.494 1.569 . . . . 0.58 111.234 177.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 85' ' ' ILE . 5.1 tp -60.5 -46.39 90.29 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.186 0.517 . . . . 0.94 109.871 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 41.6 ttm -68.33 -31.82 71.49 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.361 -0.607 . . . . 1.48 109.361 178.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.583 HG12 ' O ' ' B' ' 294' ' ' SER . 43.4 mm -62.01 -34.97 65.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.856 -0.794 . . . . 0.7 108.856 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.433 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 2.6 tttp -66.39 -40.92 89.95 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.765 -0.652 . . . . 1.21 109.85 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -61.34 -42.62 98.98 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.886 -0.783 . . . . 2.51 108.886 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' B' ' 304' ' ' ASN . 6.4 m -70.55 -30.13 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.563 -0.744 . . . . 0.81 109.858 178.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 5.6 tptp -67.68 -33.75 75.54 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.172 -0.677 . . . . 2.25 109.172 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -65.81 -37.59 86.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 108.205 -1.035 . . . . 1.76 108.205 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' B' ' 301' ' ' SER . 22.6 t30 -63.86 -41.15 97.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.76 -1.109 . . . . 1.62 108.792 177.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 115.581 -0.736 . . . . 1.68 109.602 178.202 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.663 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.64 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 120.693 0.282 . . . . 2.82 111.198 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.509 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.9 OUTLIER -55.2 -42.71 73.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.762 -0.654 . . . . 2.61 112.019 -178.637 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.47 -44.58 69.08 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.183 0.438 . . . . 1.78 112.183 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.632 ' HA ' HD11 ' B' ' 296' ' ' LEU . 2.4 mt -65.25 -41.43 91.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.993 0.425 . . . . 1.33 111.188 -179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.0 tmt_? -68.79 -43.79 74.95 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.055 -0.52 . . . . 2.26 110.827 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 91' ' ' VAL . 17.5 mm-40 -70.79 -35.04 72.38 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.86 -0.609 . . . . 1.91 112.063 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.26 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.747 0.308 . . . . 1.0 110.756 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -59.19 -42.06 89.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.554 . . . . 0.86 110.377 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.06 -29.79 66.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.903 -0.59 . . . . 1.84 110.536 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.466 ' O ' ' HE3' ' A' ' 94' ' ' LYS . 57.9 t -74.71 -41.09 47.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 1.24 110.438 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 21.0 m-30 -71.89 -37.25 70.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.069 -0.514 . . . . 1.06 110.791 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.674 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 21.2 t0 -83.68 104.89 14.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.658 -0.497 . . . . 0.95 109.658 178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 91' ' ' VAL . 5.2 mptt -91.43 -39.29 12.06 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.089 -0.505 . . . . 1.28 111.224 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.635 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 1.1 p-10 -69.48 -20.61 63.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.17 -0.468 . . . . 1.36 110.807 -178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.79 68.81 1.54 Allowed Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.153 -0.546 . . . . 1.02 112.774 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.506 ' ND2' ' HB2' ' A' ' 99' ' ' TYR . 24.2 p-10 -137.05 -0.41 2.27 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.891 0.377 . . . . 0.86 110.513 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.97 22.0 72.65 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.656 -0.783 . . . . 0.67 111.73 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.506 ' HB2' ' ND2' ' A' ' 97' ' ' ASN . 57.6 m-85 -142.82 122.86 13.63 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.688 0.28 . . . . 1.29 110.773 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.734 ' HB ' ' CG2' ' A' ' 136' ' ' VAL . 60.2 mt -82.13 102.57 8.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 108.712 -0.847 . . . . 0.56 108.712 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.6 t -76.32 163.29 27.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.592 -0.522 . . . . 1.33 109.592 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -57.5 -39.05 75.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.996 0.427 . . . . 0.75 110.459 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.42 -38.91 88.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.89 110.508 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.71 -32.52 72.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.819 -0.628 . . . . 0.86 110.692 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.732 HD22 HG12 ' A' ' 125' ' ' ILE . 10.4 tp -77.27 -34.93 55.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.263 -0.426 . . . . 0.54 110.11 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.449 ' HG2' HG21 ' A' ' 121' ' ' VAL . 19.0 mtm180 -60.01 -34.22 73.05 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.515 -0.55 . . . . 2.15 109.515 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -66.09 -28.12 68.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.44 -0.8 . . . . 1.21 109.674 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.5 -35.33 44.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.72 109.998 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -34.77 73.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.214 -0.448 . . . . 1.6 110.345 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.469 HG23 ' HE3' ' A' ' 115' ' ' LYS . 1.3 m -63.8 -36.73 84.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.903 -0.589 . . . . 1.67 110.886 179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -84.74 -27.34 27.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.145 0.498 . . . . 1.85 109.952 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.9 tp -66.84 -27.98 67.98 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.69 -0.686 . . . . 1.23 109.979 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.03 -49.77 0.86 Allowed Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.801 -0.636 . . . . 1.13 111.685 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -80.48 100.16 8.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.068 0.461 . . . . 2.09 110.019 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.469 ' HE3' HG23 ' A' ' 110' ' ' THR . 62.0 mttp -82.88 82.49 8.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.737 -0.665 . . . . 1.92 109.816 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.1 mt -72.54 166.66 22.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.689 -0.687 . . . . 1.27 111.691 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.4 p -77.4 168.67 19.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 1.08 111.095 -179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.18 -37.14 74.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.12 -0.491 . . . . 1.99 111.199 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -68.36 -37.36 80.38 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.894 0.378 . . . . 2.75 110.412 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -71.68 -34.28 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.784 -0.45 . . . . 1.14 109.784 179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.449 HG21 ' HG2' ' A' ' 106' ' ' ARG . 77.0 t -67.78 -36.8 77.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.409 -0.96 . . . . 0.86 108.409 177.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 126' ' ' ARG . 12.6 t70 -63.51 -41.99 98.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.131 -0.94 . . . . 1.38 108.572 177.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -60.65 -37.01 80.1 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.811 -0.631 . . . . 1.94 109.468 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.734 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 9.3 mtp -56.72 -51.46 68.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.218 -0.901 . . . . 0.66 111.777 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.732 HG12 HD22 ' A' ' 105' ' ' LEU . 1.4 mt -85.45 -14.07 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 119.077 -1.049 . . . . 0.85 111.382 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 122' ' ' ASP . 20.0 ttm180 -68.11 -25.26 65.22 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 107.824 -1.176 . . . . 1.7 107.824 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.429 ' HB3' ' HB3' ' B' ' 288' ' ' ALA . 4.7 tt0 -97.5 -5.44 35.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 113.898 -1.501 . . . . 1.55 109.605 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.48 ' HB3' ' HA ' ' A' ' 125' ' ' ILE . . . -101.85 -44.59 5.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.16 -0.473 . . . . 0.66 111.733 -178.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 28.6 t70 -76.59 132.38 39.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.083 0.468 . . . . 0.8 111.179 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 37.4 mt -130.29 -23.59 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.799 -0.637 . . . . 1.23 110.893 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.611 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 1.1 p-10 -77.03 -22.4 53.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.426 -0.352 . . . . 1.35 111.828 -178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 98.62 -0.21 58.01 Favored Glycine 0 C--O 1.236 0.28 0 C-N-CA 120.434 -0.889 . . . . 1.25 113.699 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.624 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.1 OUTLIER -70.49 -24.68 62.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.277 0.538 . . . . 1.06 110.078 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 99.73 -8.17 59.7 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.852 -0.689 . . . . 0.9 113.461 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -123.89 -179.63 4.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.557 0.694 . . . . 1.18 111.169 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.734 ' CG2' ' HB ' ' A' ' 100' ' ' ILE . 0.0 OUTLIER -102.89 96.61 4.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 114.644 -1.162 . . . . 1.08 109.165 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 27.7 p30 -88.71 176.01 7.27 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.48 -0.488 . . . . 0.84 109.933 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -52.85 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.627 0.603 . . . . 1.45 112.627 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 30.5 mp0 -62.59 -50.82 69.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.457 -0.338 . . . . 1.84 111.776 -178.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.423 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 39.4 mt-10 -62.67 -41.97 99.37 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.913 0.387 . . . . 0.68 110.706 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.427 ' HE2' ' O ' ' A' ' 85' ' ' ILE . 75.4 t80 -56.03 -56.25 23.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.535 -0.757 . . . . 0.85 111.365 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.42 -38.28 81.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.083 -0.508 . . . . 1.23 111.447 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -65.6 -41.52 92.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.734 0.302 . . . . 1.96 111.429 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -38.94 62.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.039 0.447 . . . . 0.89 110.913 -179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.601 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -67.46 -47.64 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.495 . . . . 1.14 110.901 179.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.64 48.68 1.02 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.226 0.536 . . . . 1.53 109.895 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.45 101.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.671 -0.695 . . . . 1.64 110.804 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.308 -0.853 . . . . 3.35 109.833 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . 0.431 ' HB3' ' OD1' ' B' ' 290' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.723 0.297 . . . . 2.21 110.23 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.734 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -114.96 -33.9 5.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.254 -0.43 . . . . 1.57 111.178 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -48.33 -30.37 4.84 Favored 'General case' 0 C--O 1.226 -0.184 0 O-C-N 123.914 0.759 . . . . 1.18 112.344 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.483 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 20.3 p-10 -92.79 -34.18 13.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.302 0.482 . . . . 1.07 112.302 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.484 ' O ' ' HD3' ' B' ' 295' ' ' PRO . 9.6 mp -68.79 -46.66 68.14 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-O 118.3 -0.857 . . . . 1.52 112.724 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.609 ' CZ3' HG11 ' A' ' 136' ' ' VAL . 59.8 m95 -52.98 -50.9 79.33 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-N 119.738 1.153 . . . . 0.48 109.927 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.592 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -64.01 -17.48 59.95 Favored 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 121.631 1.554 . . . . 0.61 112.385 177.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.584 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 74.2 m -60.32 -61.52 7.77 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-O 118.547 -0.739 . . . . 0.67 110.289 178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.592 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 31.9 Cg_exo -60.88 -27.47 84.85 Favored 'Trans proline' 0 C--N 1.37 1.673 0 CA-C-N 121.481 1.565 . . . . 0.58 110.19 176.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 85' ' ' ILE . 4.4 tp -59.49 -47.74 84.33 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.041 -0.725 . . . . 0.94 109.041 177.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 50.3 ttm -67.33 -32.44 73.39 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.753 -0.658 . . . . 1.48 109.265 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.56 HG12 ' O ' ' B' ' 294' ' ' SER . 45.2 mm -65.66 -31.46 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.63 -0.714 . . . . 0.7 109.108 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -38.0 87.68 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.977 -1.12 . . . . 1.21 107.977 177.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' B' ' 303' ' ' LYS . 0.4 OUTLIER -65.36 -35.94 82.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.244 -0.889 . . . . 2.51 108.733 177.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 14.4 m -69.83 -36.43 75.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 108.659 -0.867 . . . . 0.81 108.659 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 16.5 tptp -67.75 -31.34 71.18 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.902 -0.777 . . . . 2.25 108.902 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . 0.415 ' HB3' ' O ' ' B' ' 300' ' ' ARG . 17.9 tttp -63.52 -43.73 96.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.214 -0.903 . . . . 1.76 108.794 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -69.49 -37.36 77.2 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.374 -0.83 . . . . 1.62 109.137 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.711 -0.677 . . . . 1.68 109.403 178.06 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.674 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.624 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 121.093 0.473 . . . . 2.82 110.709 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 83' ' ' GLU . 0.8 OUTLIER -62.06 -29.94 70.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.716 -0.674 . . . . 2.61 110.313 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -57.54 -47.66 81.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.417 -0.811 . . . . 1.78 110.516 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.0 mt -72.02 -32.43 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.99 -0.55 . . . . 1.33 110.672 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -65.3 -45.79 82.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.116 -0.493 . . . . 2.26 110.157 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.509 ' O ' HG23 ' A' ' 91' ' ' VAL . 3.3 tt0 -66.62 -38.21 86.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 1.91 109.818 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.39 82.08 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.002 -0.544 . . . . 1.0 110.41 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.81 -40.9 89.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.086 -0.506 . . . . 0.86 110.407 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -66.33 -36.62 83.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.869 -0.605 . . . . 1.84 110.737 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 87' ' ' GLU . 58.6 t -71.84 -36.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.175 -0.466 . . . . 1.24 110.472 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.436 ' CZ ' HG11 ' A' ' 108' ' ' VAL . 3.7 m-30 -66.44 -54.03 28.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.476 . . . . 1.06 110.052 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.658 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 23.4 t0 -83.89 96.68 8.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.95 110.014 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -90.65 -34.6 15.37 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.71 -0.677 . . . . 1.28 111.63 -178.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.671 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 1.1 p-10 -68.72 -25.64 64.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.839 0.352 . . . . 1.36 110.7 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.28 44.02 7.19 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.853 -0.689 . . . . 1.02 113.121 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.57 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 4.8 p-10 -97.1 -7.56 32.38 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.731 -0.47 . . . . 0.86 109.731 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.2 0.7 76.71 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.848 -0.614 . . . . 0.67 113.576 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' A' ' 97' ' ' ASN . 71.3 m-85 -141.09 155.33 46.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.88 0.371 . . . . 1.29 110.639 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.674 ' HB ' HG23 ' A' ' 136' ' ' VAL . 84.9 mt -83.67 100.48 7.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.89 -0.781 . . . . 0.56 108.89 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.4 t -72.51 155.45 40.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.432 -0.349 . . . . 1.33 110.426 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.57 -35.81 75.0 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.119 0.485 . . . . 0.75 110.229 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.18 -37.89 81.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.89 109.972 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.51 -30.41 61.79 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.664 -0.698 . . . . 0.86 110.142 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.719 HD22 HG12 ' A' ' 125' ' ' ILE . 18.8 tp -72.15 -40.64 67.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.859 -0.609 . . . . 0.54 109.954 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 1.042 ' HG2' HG11 ' A' ' 121' ' ' VAL . 20.3 mtm180 -57.61 -33.35 68.14 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.466 -0.334 . . . . 2.15 110.586 179.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.795 -0.639 . . . . 1.21 109.744 179.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.436 HG11 ' CZ ' ' A' ' 92' ' ' PHE . 16.0 t -70.43 -40.82 78.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.724 -0.671 . . . . 0.72 110.403 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.616 ' SD ' ' HG ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -61.12 -46.95 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.939 -0.573 . . . . 1.6 111.049 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.7 p -70.57 -32.58 70.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.885 0.374 . . . . 1.67 111.157 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -71.03 -28.16 64.19 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.285 -0.416 . . . . 1.85 110.156 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 51.7 tp -64.69 -29.56 70.56 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.82 -0.627 . . . . 1.23 110.465 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 111.3 -41.72 2.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.854 -0.688 . . . . 1.13 111.701 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -74.07 100.49 3.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.28 0.562 . . . . 2.09 109.784 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 29.2 mttp -81.87 123.13 28.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.509 -0.768 . . . . 1.92 111.268 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 15.0 mt -118.45 162.56 18.14 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.727 -0.67 . . . . 1.27 109.698 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.412 ' O ' HG23 ' A' ' 121' ' ' VAL . 26.6 p -75.07 168.22 20.4 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.992 -0.373 . . . . 1.08 109.992 179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -59.3 -36.5 75.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.947 0.403 . . . . 1.99 110.249 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.01 -45.03 83.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.712 -0.677 . . . . 2.75 110.155 179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -66.75 -38.41 86.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 1.14 110.708 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 1.042 HG11 ' HG2' ' A' ' 106' ' ' ARG . 85.1 t -67.12 -40.89 86.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.481 -0.563 . . . . 0.86 109.481 178.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.553 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 21.3 t70 -64.5 -40.07 94.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.046 -0.724 . . . . 1.38 109.046 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.04 -35.24 74.68 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.563 -0.532 . . . . 1.94 109.563 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.61 ' HG2' ' CB ' ' B' ' 288' ' ' ALA . 4.8 mtp -55.86 -45.08 78.59 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 0.66 109.763 178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.994 HD11 HG22 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -81.05 -27.82 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.845 -0.616 . . . . 0.85 111.202 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 44.2 mtm-85 -68.92 -19.93 64.21 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.451 0.643 . . . . 1.7 109.663 178.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.17 -13.28 26.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.056 -0.975 . . . . 1.55 109.876 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.751 ' HB3' HD13 ' A' ' 125' ' ' ILE . . . -102.44 -35.82 8.64 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.736 -0.666 . . . . 0.66 111.572 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.647 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 27.0 t0 -83.47 104.87 13.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.936 0.398 . . . . 0.8 110.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.66 -32.4 3.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.854 -0.612 . . . . 1.23 111.303 -178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.626 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -74.8 -12.93 60.51 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.781 0.324 . . . . 1.35 111.375 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 69.53 61.02 4.68 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.102 -0.57 . . . . 1.25 112.538 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.619 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.9 OUTLIER -118.46 -19.85 8.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.552 0.215 . . . . 1.06 110.669 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.27 -22.46 32.86 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.669 -0.777 . . . . 0.9 112.941 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -122.81 173.29 7.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 1.18 111.047 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.994 HG22 HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -101.02 109.83 26.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.531 -0.759 . . . . 1.08 109.233 179.497 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 24.4 p30 -89.69 174.13 7.91 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.399 -0.521 . . . . 0.84 110.152 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -55.36 -49.54 72.01 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.46 0.541 . . . . 1.45 112.46 -178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.92 -52.98 63.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.316 -0.402 . . . . 1.84 111.863 -179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.402 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 45.3 mt-10 -61.57 -37.14 82.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.936 0.398 . . . . 0.68 110.624 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -56.55 -54.83 41.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.85 110.797 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 49.7 t -70.23 -41.36 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.798 -0.637 . . . . 1.23 111.423 -179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -58.34 -52.29 66.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.198 -0.456 . . . . 1.96 112.156 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.431 ' HE1' ' CD1' ' B' ' 292' ' ' TRP . 0.0 OUTLIER -66.38 -44.2 83.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.268 -0.424 . . . . 0.89 112.028 -178.122 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.453 ' HE2' ' O ' ' B' ' 292' ' ' TRP . 36.4 mtt -69.1 -45.16 70.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.829 0.347 . . . . 1.14 111.702 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 63.14 2.45 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.026 0.441 . . . . 1.53 110.214 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -94.99 157.16 16.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.91 -0.586 . . . . 1.64 111.326 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.301 -0.857 . . . . 3.35 109.169 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 109.363 -0.606 . . . . 2.21 109.363 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.61 ' CB ' ' HG2' ' A' ' 124' ' ' MET . . . -116.55 0.72 12.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.859 -0.61 . . . . 1.57 111.829 -177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -39.39 -29.88 0.06 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.645 0.98 . . . . 1.18 113.645 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.484 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 9.0 p-10 -83.66 -21.69 32.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 117.607 0.185 . . . . 1.07 111.305 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.825 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 2.1 mp -71.5 -40.02 70.43 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-O 118.999 -0.524 . . . . 1.52 111.343 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.656 ' HB2' ' HD3' ' B' ' 293' ' ' PRO . 64.1 m95 -56.4 -51.68 79.09 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 119.235 -0.986 . . . . 0.48 108.8 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 51.2 Cg_exo -60.15 -19.71 58.07 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.59 1.527 . . . . 0.61 112.354 176.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.531 ' O ' HG12 ' B' ' 298' ' ' ILE . 49.6 m -57.08 -63.66 3.41 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.802 -0.618 . . . . 0.67 110.29 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.825 ' HD2' ' O ' ' B' ' 291' ' ' LEU . 11.2 Cg_endo -58.78 -29.61 90.29 Favored 'Trans proline' 0 C--N 1.369 1.61 0 CA-C-N 120.915 1.363 . . . . 0.58 110.94 176.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.442 HD13 ' SD ' ' A' ' 145' ' ' MET . 8.3 tp -64.57 -39.01 92.97 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.098 -0.705 . . . . 0.94 109.098 177.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 38.4 ttm -70.63 -32.81 70.27 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.655 -0.869 . . . . 1.48 108.655 178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.531 HG12 ' O ' ' B' ' 294' ' ' SER . 49.0 mm -65.42 -29.88 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 N-CA-C 108.502 -0.925 . . . . 0.7 108.502 177.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -39.36 82.74 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.515 -0.921 . . . . 1.21 108.515 178.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -64.66 -39.81 94.33 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.58 -0.896 . . . . 2.51 108.58 177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 8.8 m -69.19 -36.35 77.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.14 -0.936 . . . . 0.81 109.468 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -64.53 -37.08 86.3 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.24 -0.652 . . . . 2.25 109.24 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 26.4 ttmt -62.18 -43.61 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.833 -0.621 . . . . 1.76 109.356 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -68.12 -43.32 78.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.592 -0.731 . . . . 1.62 109.454 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.626 . . . . 1.68 109.988 179.509 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.671 'CA ' ' OD1' ' A' ' 95' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.647 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.628 0.251 . . . . 2.82 111.063 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 1.6 mp0 -57.54 -40.84 79.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 2.61 110.909 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.413 ' OE2' ' HE2' ' B' ' 299' ' ' LYS . 0.5 OUTLIER -60.62 -35.89 77.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 1.78 110.452 179.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.579 ' HA ' HD11 ' B' ' 296' ' ' LEU . 5.1 mt -71.98 -40.96 68.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.71 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG3' ' OH ' ' A' ' 138' ' ' TYR . 42.9 ttt-85 -65.71 -47.74 74.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.304 -0.407 . . . . 2.26 110.449 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.419 ' O ' HG23 ' A' ' 91' ' ' VAL . 21.7 mm-40 -68.43 -26.85 65.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 1.91 110.814 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.05 -38.62 89.42 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.114 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -59.62 -39.36 84.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.86 109.945 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -67.34 -38.88 85.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.894 -0.594 . . . . 1.84 110.185 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 87' ' ' GLU . 61.4 t -70.9 -35.58 60.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 1.24 110.484 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -69.13 -49.96 52.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.943 -0.571 . . . . 1.06 109.958 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.662 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 22.3 t0 -81.6 74.48 8.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.426 -0.806 . . . . 0.95 109.741 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.2 mttt -66.97 -28.81 68.57 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.23 -0.896 . . . . 1.28 111.763 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.621 ' OD1' 'CA ' ' A' 1000 ' ' ' CA' . 0.0 OUTLIER -74.8 -31.32 61.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.825 0.345 . . . . 1.36 110.471 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.53 60.55 2.62 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.895 -0.669 . . . . 1.02 113.23 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB3' ' OD2' ' A' ' 95' ' ' ASP . 7.6 p-10 -122.99 -7.02 8.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.047 0.451 . . . . 0.86 110.097 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.11 10.53 68.76 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.742 -0.663 . . . . 0.67 112.965 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -142.51 129.59 20.82 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.883 0.373 . . . . 1.29 111.221 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.62 ' HB ' HG22 ' A' ' 136' ' ' VAL . 54.9 mt -79.68 103.04 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 108.941 -0.763 . . . . 0.56 108.941 178.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 43.9 t -82.0 160.62 23.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.829 -0.623 . . . . 1.33 110.255 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.5 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -59.01 -39.09 80.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 0.75 110.304 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.37 -35.58 81.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.89 110.558 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -74.35 -36.96 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.976 -0.556 . . . . 0.86 110.055 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.556 HD22 ' CG1' ' A' ' 125' ' ' ILE . 12.4 tp -66.94 -34.5 77.9 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.254 0.549 . . . . 0.54 109.562 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 102' ' ' ALA . 16.1 mtm180 -70.22 -15.69 62.96 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.879 -0.6 . . . . 2.15 110.198 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.92 4.3 52.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.321 0.581 . . . . 1.21 110.13 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 78.2 t -114.14 -49.44 5.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.41 -0.814 . . . . 0.72 109.276 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.55 -8.42 51.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.883 . . . . 1.6 111.826 -179.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.458 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -72.53 -41.55 65.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.366 0.603 . . . . 1.67 109.63 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -78.12 -14.56 59.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.415 -0.812 . . . . 1.85 109.919 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 294' ' ' SER . 9.4 tt -63.54 -32.62 74.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.102 -0.954 . . . . 1.23 110.135 179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 110.57 -62.57 0.29 Allowed Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.242 -0.743 . . . . 1.13 111.242 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.53 82.31 4.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.243 0.544 . . . . 2.09 110.161 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 110' ' ' THR . 34.8 mttp -81.73 111.16 17.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.713 -0.676 . . . . 1.92 110.214 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.531 HD21 HD22 ' B' ' 291' ' ' LEU . 0.1 OUTLIER -85.33 175.25 9.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.334 -0.394 . . . . 1.27 110.816 -179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.481 ' O ' HG23 ' A' ' 121' ' ' VAL . 37.0 p -73.61 163.62 27.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.386 -0.37 . . . . 1.08 110.903 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -61.48 -31.41 71.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.956 0.408 . . . . 1.99 110.211 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -64.31 -40.26 95.56 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.48 0.657 . . . . 2.75 109.404 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 116' ' ' LEU . 46.6 mt-10 -74.44 -33.19 62.87 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.328 -0.851 . . . . 1.14 110.223 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 117' ' ' THR . 81.8 t -61.43 -40.23 85.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 108.225 -1.028 . . . . 0.86 108.225 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.23 -45.0 95.28 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.653 -1.158 . . . . 1.38 109.531 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.61 -38.32 90.59 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.0 -0.546 . . . . 1.94 110.204 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.607 ' HA ' ' HB2' ' B' ' 288' ' ' ALA . 6.5 mtp -59.5 -48.0 83.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.041 -0.527 . . . . 0.66 111.136 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.635 HD13 HG13 ' A' ' 136' ' ' VAL . 0.2 OUTLIER -73.97 -35.27 41.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 C-N-CA 120.539 -0.465 . . . . 0.85 110.414 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 126' ' ' ARG . 28.5 mtm180 -64.62 -34.05 77.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.051 0.453 . . . . 1.7 110.018 178.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -73.45 -17.78 61.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.485 0.66 . . . . 1.55 109.417 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.454 ' HB3' HG11 ' A' ' 136' ' ' VAL . . . -108.17 8.69 28.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.378 -0.828 . . . . 0.66 110.21 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.646 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 27.3 t0 -117.17 116.03 26.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.049 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 9.7 mt -108.53 -29.45 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.155 -0.475 . . . . 1.23 110.734 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.617 ' OD1' 'CA ' ' A' 1001 ' ' ' CA' . 0.6 OUTLIER -77.22 -15.24 59.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 1.35 110.64 -179.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.45 60.66 4.58 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.239 -0.505 . . . . 1.25 112.819 179.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.534 ' HB3' ' OD2' ' A' ' 131' ' ' ASP . 0.6 OUTLIER -123.66 -17.08 6.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.586 0.231 . . . . 1.06 111.468 -179.259 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.05 -3.79 55.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.371 -0.918 . . . . 0.9 113.065 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -136.41 161.45 35.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.696 -0.483 . . . . 1.18 109.696 179.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.635 HG13 HD13 ' A' ' 125' ' ' ILE . 3.2 m -106.81 115.46 48.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 108.865 -0.791 . . . . 1.08 108.865 178.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.595 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 30.2 p30 -88.54 -176.22 5.22 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.851 -0.425 . . . . 0.84 109.851 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.405 ' OH ' ' HG3' ' A' ' 86' ' ' ARG . 18.7 t80 -59.34 -45.88 90.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.755 0.312 . . . . 1.45 111.746 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -62.28 -42.03 99.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.279 -0.419 . . . . 1.84 111.249 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.595 ' HG3' ' OD1' ' A' ' 137' ' ' ASN . 26.4 mt-10 -73.34 -32.17 64.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.29 0.567 . . . . 0.68 110.132 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -61.83 -56.94 14.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.244 -0.889 . . . . 0.85 110.851 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.1 t -61.55 -33.01 55.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 115.851 -0.613 . . . . 1.23 110.807 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.67 -38.69 90.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.021 -0.536 . . . . 1.96 111.1 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.69 -43.37 26.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.305 -0.407 . . . . 0.89 111.421 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.488 ' CE ' ' HB3' ' B' ' 292' ' ' TRP . 0.1 OUTLIER -66.24 -49.37 67.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.255 -0.429 . . . . 1.14 111.903 -179.178 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.32 31.14 2.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.972 0.415 . . . . 1.53 111.082 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.67 121.14 10.88 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.861 -0.609 . . . . 1.64 111.448 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.497 -0.763 . . . . 3.35 109.569 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 287' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 . . . . . 0 N--CA 1.481 1.077 0 CA-C-O 120.799 0.333 . . . . 2.21 110.531 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 288' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 124' ' ' MET . . . -63.26 -47.36 82.73 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 1.57 111.345 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 289' ' ' ALA . . . . . . . . . . . . . . . -44.36 -45.1 8.68 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 113.363 0.875 . . . . 1.18 113.363 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 290' ' ' ASN . . . . . 0.484 ' C ' ' HD2' ' B' ' 293' ' ' PRO . 6.3 p-10 -90.72 -26.99 19.25 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.55 0.574 . . . . 1.07 112.55 -179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 291' ' ' LEU . . . . . 0.531 HD22 HD21 ' A' ' 116' ' ' LEU . 0.2 OUTLIER -68.93 -45.12 71.61 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 120.172 -0.611 . . . . 1.52 112.624 -178.449 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 292' ' ' TRP . . . . . 0.661 ' O ' ' HD2' ' B' ' 295' ' ' PRO . 89.5 m95 -54.68 -51.5 78.17 Favored Pre-proline 0 CA--C 1.555 1.145 0 CA-C-N 118.809 0.731 . . . . 0.48 109.739 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 293' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 292' ' ' TRP . 36.0 Cg_exo -62.57 -18.35 63.19 Favored 'Trans proline' 0 C--N 1.363 1.321 0 C-N-CA 121.506 1.471 . . . . 0.61 112.326 177.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 294' ' ' SER . . . . . 0.603 ' HB2' ' HD3' ' B' ' 295' ' ' PRO . 61.6 m -58.74 -60.85 9.08 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 118.374 -0.822 . . . . 0.67 110.414 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 295' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' B' ' 292' ' ' TRP . 35.2 Cg_exo -60.94 -29.7 88.54 Favored 'Trans proline' 0 C--N 1.373 1.829 0 CA-C-N 121.359 1.521 . . . . 0.58 110.562 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 85' ' ' ILE . 7.0 tp -61.14 -44.18 97.72 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.095 -0.706 . . . . 0.94 109.095 177.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 297' ' ' MET . . . . . . . . . . . . . 30.8 ttm -64.91 -35.91 82.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.373 -0.83 . . . . 1.48 109.072 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 298' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 294' ' ' SER . 39.7 mm -61.72 -33.38 57.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.652 -0.703 . . . . 0.7 109.476 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 299' ' ' LYS . . . . . 0.413 ' HE2' ' OE2' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -64.65 -40.29 95.19 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 108.777 -0.823 . . . . 1.21 108.777 178.317 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.8 -44.69 84.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.482 -0.781 . . . . 2.51 109.34 178.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 301' ' ' SER . . . . . . . . . . . . . 18.2 m -64.41 -36.31 83.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.973 -0.558 . . . . 0.81 109.738 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 302' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -66.18 -33.38 75.62 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.901 -0.777 . . . . 2.25 108.901 178.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 303' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -69.26 -32.13 71.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.333 -0.849 . . . . 1.76 109.217 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 304' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -72.83 -46.09 54.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.472 -0.786 . . . . 1.62 110.009 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 305' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.451 -0.389 0 CA-C-N 116.396 -0.365 . . . . 1.68 110.029 179.37 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1000 ' ' ' CA' . . . . . 0.662 'CA ' ' OD1' ' A' ' 93' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' ' CA' . . . . . 0.646 'CA ' ' OD1' ' A' ' 129' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_