data_6iav_residue ############################ # Computer software used # ############################ 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 6iav _Structure_validation_residue.Date_analyzed 2019-01-25 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 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.899 0 N-CA-C 108.002 -1.11 . . . . 68.16 108.002 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.7 m 60.25 34.0 20.95 Favored 'General case' 0 C--O 1.276 2.468 0 C-N-CA 124.825 1.25 . . . . 57.57 113.638 175.957 -58.031 -66.683 -92.242 104.8 2.085 104.094 -79.056 -64.207 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.53 167.29 22.56 Favored 'General case' 0 C--O 1.18 -2.592 0 O-C-N 124.421 1.076 . . . . 49.84 110.754 173.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -146.93 142.3 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 104.425 -2.435 . . . . 43.63 104.425 175.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -101.11 118.7 37.51 Favored 'General case' 0 C--O 1.198 -1.642 0 O-C-N 126.333 2.27 . . . . 72.49 106.536 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.8 tt -127.4 139.78 50.95 Favored 'Isoleucine or valine' 0 C--O 1.157 -3.77 0 CA-C-N 120.864 1.666 . . . . 47.03 110.091 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -117.42 138.23 51.97 Favored 'General case' 0 C--O 1.297 3.579 0 N-CA-C 105.022 -2.214 . . . . 76.77 105.022 -177.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.66 127.2 7.6 Favored Glycine 0 N--CA 1.485 1.935 0 O-C-N 128.394 3.559 . . . . 50.76 107.503 166.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . 0.522 ' O ' ' NE2' ' A' ' 46' ' ' HIS . 56.2 p30 -109.08 -177.19 3.24 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 119.292 1.546 . . . . 75.76 109.923 -175.269 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.51 -9.91 10.16 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 129.368 3.067 . . . . 83.12 114.497 168.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -105.14 12.19 32.33 Favored 'General case' 0 C--O 1.276 2.483 0 CA-C-N 123.105 2.684 . . . . 85.14 110.581 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.1 ttm 70.37 41.82 0.97 Allowed 'General case' 0 C--O 1.191 -2.0 0 N-CA-C 106.342 -1.725 . . . . 69.12 106.342 166.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -123.67 133.13 53.95 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.974 1.31 . . . . 68.46 110.838 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -86.34 145.86 26.72 Favored 'General case' 1 C--O 1.118 -5.817 0 CA-C-O 115.92 -1.99 . . . . 54.38 108.132 160.74 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.2 p-10 -83.3 18.05 1.89 Allowed 'General case' 0 N--CA 1.51 2.526 0 CA-C-N 123.652 2.933 . . . . 59.42 107.836 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -158.39 153.58 25.56 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 116.873 -3.642 . . . . 59.76 105.849 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -138.8 10.93 2.66 Favored 'General case' 0 C--O 1.182 -2.469 0 O-C-N 124.62 1.2 . . . . 79.97 108.255 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.91 135.54 15.25 Favored 'General case' 0 C--O 1.266 1.946 0 CA-C-N 119.564 1.074 . . . . 48.47 111.283 166.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mt -123.33 132.83 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 125.524 1.529 . . . . 44.68 107.592 -178.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.338 21.2 p -112.6 123.51 50.47 Favored 'General case' 0 C--O 1.174 -2.876 0 N-CA-C 105.044 -2.206 . . . . 61.47 105.044 175.292 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.7 t -97.6 113.05 31.03 Favored 'Isoleucine or valine' 0 C--O 1.297 3.603 0 C-N-CA 128.235 2.614 . . . . 45.92 107.524 168.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -56.12 131.33 47.34 Favored 'General case' 0 C--O 1.283 2.852 0 O-C-N 120.695 -1.253 . . . . 74.2 108.744 172.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -12.1 61.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 117.435 -1.269 . . . . 86.18 109.594 -174.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -80.09 -20.22 45.63 Favored 'General case' 0 C--O 1.284 2.898 0 O-C-N 125.113 1.508 . . . . 71.32 109.38 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.6 m -66.67 135.82 54.62 Favored 'General case' 0 C--O 1.29 3.191 0 CA-C-N 120.127 1.331 . . . . 65.61 109.501 178.036 -64.207 -79.056 -92.242 104.094 2.085 104.8 -66.683 -58.031 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -93.03 -32.96 14.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 116.51 -1.71 . . . . 67.06 107.654 169.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -124.88 144.39 50.34 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 121.191 1.814 . . . . 67.55 111.159 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -123.71 132.41 53.82 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 121.761 2.073 . . . . 33.75 106.826 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.2 m -108.19 135.22 49.88 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.543 0.687 . . . . 44.53 111.18 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 77.5 t -105.69 134.12 48.11 Favored 'Isoleucine or valine' 0 C--O 1.285 2.947 0 O-C-N 120.486 -1.384 . . . . 33.02 108.623 162.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -112.46 108.91 18.21 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 107.768 -1.197 . . . . 47.22 107.768 171.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.59 140.59 35.67 Favored 'General case' 0 C--O 1.285 2.962 0 N-CA-C 106.163 -1.792 . . . . 45.88 106.163 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.5 p -137.2 160.8 37.96 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 116.842 -1.551 . . . . 49.15 107.745 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 36' ' ' PRO . 2.5 t-80 -114.98 96.65 45.63 Favored Pre-proline 0 N--CA 1.482 1.133 0 C-N-CA 127.347 2.259 . . . . 55.37 110.118 175.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' O ' ' O ' ' A' ' 37' ' ' GLY . 21.5 Cg_endo -68.15 -172.4 0.42 Allowed 'Trans proline' 0 C--O 1.255 1.371 0 CA-C-N 122.457 1.913 . . . . 64.59 113.424 161.996 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . 0.53 ' O ' ' O ' ' A' ' 36' ' ' PRO . . . 62.46 150.97 0.03 OUTLIER Glycine 0 N--CA 1.501 2.985 0 O-C-N 116.532 -3.855 . . . . 73.74 111.896 174.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -99.68 7.53 45.08 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 127.684 2.394 . . . . 88.49 110.633 -147.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.91 137.32 26.78 Favored Pre-proline 0 N--CA 1.511 2.611 0 C-N-CA 117.927 -1.509 . . . . 67.21 109.403 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.61 160.68 25.1 Favored 'Trans proline' 0 C--O 1.199 -1.46 0 N-CA-C 116.389 1.65 . . . . 70.9 116.389 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -53.99 -41.92 68.45 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 127.032 2.133 . . . . 62.29 111.184 -164.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -71.16 -12.38 61.45 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 117.044 -1.455 . . . . 67.32 109.504 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.1 t -111.3 -46.33 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 117.402 -1.285 . . . . 69.45 109.063 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.4 tpp -129.86 43.58 3.1 Favored 'General case' 0 C--O 1.282 2.808 0 C-N-CA 123.977 0.911 . . . . 63.55 109.945 -174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 137.76 38.99 Favored Glycine 0 C--O 1.278 2.901 0 C-N-CA 121.121 -0.561 . . . . 45.99 114.233 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . 0.522 ' NE2' ' O ' ' A' ' 10' ' ' ASN . 42.9 m-70 -130.02 142.56 50.61 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 120.217 -0.593 . . . . 40.9 109.633 175.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -136.14 172.48 12.95 Favored 'General case' 0 C--O 1.202 -1.435 0 O-C-N 126.895 2.622 . . . . 37.53 106.96 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -125.76 120.0 29.42 Favored 'General case' 0 C--O 1.168 -3.234 1 C-N-CA 131.953 4.101 . . . . 29.52 103.063 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.8 t -132.61 130.32 59.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 O-C-N 128.422 3.576 . . . . 27.91 107.57 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.9 tp -108.62 132.49 53.84 Favored 'General case' 0 C--O 1.2 -1.541 0 N-CA-C 107.23 -1.396 . . . . 32.43 107.23 177.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 94.6 p -142.61 -179.91 6.59 Favored 'General case' 0 C--O 1.28 2.688 0 N-CA-C 106.741 -1.577 . . . . 38.99 106.741 163.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.1 p -59.62 153.74 19.28 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 124.192 0.932 . . . . 43.65 110.674 160.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.99 -44.33 78.47 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.814 0.445 . . . . 45.63 111.665 168.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.12 -43.24 73.9 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.741 0.817 . . . . 48.16 111.418 176.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -83.21 -14.4 53.4 Favored 'General case' 0 C--O 1.26 1.644 0 N-CA-C 116.276 1.954 . . . . 53.12 116.276 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 13.9 ttt -55.91 -46.3 78.45 Favored 'General case' 0 C--O 1.203 -1.373 0 CA-C-N 120.416 1.462 . . . . 53.84 110.904 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.253 1.2 pp0? -66.18 -38.51 88.2 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 123.973 3.079 . . . . 56.24 109.498 -172.589 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.75 -42.8 99.63 Favored Glycine 0 N--CA 1.504 3.198 0 N-CA-C 110.528 -1.029 . . . . 44.61 110.528 -178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.9 t -61.63 -51.24 75.17 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.391 0 N-CA-C 105.969 -1.863 . . . . 34.45 105.969 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.2 t -62.29 -48.62 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.491 0 CA-C-N 122.052 2.206 . . . . 31.66 107.741 -172.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.348 26.4 p -71.37 -34.22 70.24 Favored 'General case' 0 C--O 1.162 -3.515 0 CA-C-O 115.007 -2.425 . . . . 49.98 109.527 -173.335 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . 0.304 78.2 m-20 -67.34 -37.64 83.61 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-N 121.108 1.776 . . . . 44.8 108.785 173.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -63.29 -47.5 87.31 Favored Glycine 0 C--N 1.383 3.157 0 O-C-N 124.811 1.319 . . . . 37.55 112.429 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . 0.518 ' CE ' ' SD ' ' B' ' 64' ' ' MET . 24.8 ttp -57.34 -42.83 82.71 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 118.48 1.14 . . . . 62.95 110.725 176.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.74 -23.18 67.26 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 115.449 -2.215 . . . . 49.52 110.194 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -83.79 -26.01 29.96 Favored 'General case' 0 C--O 1.265 1.877 0 CA-C-N 121.745 2.066 . . . . 45.88 112.679 -177.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.74 170.41 46.2 Favored Glycine 1 C--O 1.303 4.442 0 CA-C-N 119.912 1.233 . . . . 42.15 113.584 173.841 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.36 -29.96 68.06 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.32 1.848 . . . . 51.77 110.796 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -40.41 -58.13 1.62 Allowed 'General case' 0 C--O 1.194 -1.818 0 C-N-CA 124.625 1.17 . . . . 98.79 109.241 171.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.1 mmtm -100.73 24.87 8.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 127.885 2.474 . . . . 58.39 112.813 -170.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 56.4 27.51 12.16 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 122.489 1.138 . . . . 51.99 110.355 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 53.56 46.09 26.8 Favored 'General case' 1 C--O 1.315 4.55 0 O-C-N 118.144 -2.848 . . . . 40.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 59.0 mt -136.85 155.19 50.11 Favored 'General case' 0 C--O 1.186 -2.264 0 N-CA-C 108.373 -0.973 . . . . 28.46 108.373 166.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 41.4 tttt -77.34 121.08 83.94 Favored Pre-proline 0 N--CA 1.504 2.259 1 N-CA-C 99.532 -4.247 . . . . 39.5 99.532 -178.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -46.12 133.29 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.57 2.846 . . . . 43.91 110.923 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 55.99 23.7 6.98 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 127.692 2.397 . . . . 63.54 112.787 173.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -44.76 107.54 0.1 Allowed 'General case' 1 C--O 1.326 5.087 0 N-CA-C 103.541 -2.763 . . . . 47.03 103.541 173.219 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 91.6 p -72.37 -7.87 51.95 Favored 'General case' 0 C--O 1.261 1.673 0 O-C-N 126.238 2.211 . . . . 48.55 108.432 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -83.1 -14.52 53.52 Favored 'General case' 0 C--O 1.172 -2.999 0 CA-C-N 121.247 1.84 . . . . 47.14 109.645 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 83.8 t -80.18 113.64 19.88 Favored 'Isoleucine or valine' 0 C--O 1.16 -3.646 0 O-C-N 125.351 1.657 . . . . 32.33 109.155 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.9 mt -76.21 -43.37 37.36 Favored 'Isoleucine or valine' 0 C--O 1.179 -2.618 0 C-N-CA 115.467 -2.493 . . . . 45.22 106.6 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.53 159.93 41.23 Favored 'General case' 0 C--O 1.154 -3.963 0 N-CA-C 107.547 -1.279 . . . . 32.05 107.547 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 14.6 p80 -160.79 150.5 17.36 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.324 -0.991 . . . . 30.94 108.324 174.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.8 p -82.6 170.64 14.94 Favored 'General case' 1 C--O 1.144 -4.486 0 N-CA-C 114.714 1.376 . . . . 30.7 114.714 158.841 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -54.32 151.14 7.79 Favored 'General case' 0 C--O 1.157 -3.783 0 C-N-CA 129.56 3.144 . . . . 62.98 110.141 153.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 16.4 tp -79.82 128.27 33.23 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 128.328 3.518 . . . . 46.21 104.593 171.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 33.6 pt -131.31 148.86 32.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 O-C-N 124.106 0.879 . . . . 45.04 110.207 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.42 179.18 20.26 Favored Glycine 0 C--O 1.289 3.539 0 O-C-N 126.581 2.426 . . . . 54.61 111.976 165.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.1 t -31.04 132.59 0.09 Allowed 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 126.793 2.037 . . . . 63.63 110.789 -176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.6 -12.37 6.08 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 116.275 -2.403 . . . . 64.27 112.923 171.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -87.89 169.35 12.11 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 122.46 3.13 . . . . 65.46 108.743 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -144.15 161.01 39.94 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 115.826 -2.035 . . . . 66.24 106.306 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -155.9 164.48 38.44 Favored 'General case' 0 C--O 1.184 -2.357 0 O-C-N 126.378 2.298 . . . . 42.77 107.147 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.9 t -139.31 145.6 39.3 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 127.51 2.324 . . . . 46.97 107.358 -166.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.9 p -141.9 140.53 30.12 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.83 0 O-C-N 126.03 2.081 . . . . 36.85 106.837 166.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.1 m -111.29 153.6 25.69 Favored 'General case' 1 C--O 1.308 4.133 0 CA-C-O 114.391 -2.718 . . . . 35.34 106.718 168.082 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -148.41 158.27 44.0 Favored 'General case' 0 CA--C 1.486 -1.483 0 O-C-N 125.938 2.024 . . . . 37.21 109.202 175.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.2 130.6 36.5 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 128.2 3.437 . . . . 80.94 109.064 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.8 t -72.25 -22.15 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 121.359 -0.838 . . . . 46.99 108.985 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.0 p -53.81 -26.66 25.15 Favored 'General case' 0 N--CA 1.513 2.723 0 CA-C-O 116.445 -1.74 . . . . 51.07 111.993 168.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -69.36 -19.61 63.84 Favored 'General case' 0 C--O 1.199 -1.584 0 CA-C-N 120.608 1.549 . . . . 63.1 110.244 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.2 mt -97.9 157.2 16.23 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.267 1.027 . . . . 65.48 112.174 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.9 mtpm? -134.91 144.76 47.67 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.446 1.498 . . . . 88.41 108.423 170.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 148.87 46.97 Favored 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 108.128 -1.064 . . . . 91.19 108.128 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 62.18 -1.32 1.45 Allowed Glycine 0 C--O 1.29 3.632 0 C-N-CA 127.573 2.511 . . . . 96.25 116.0 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -87.17 146.02 26.18 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 121.273 2.537 . . . . 97.53 106.564 171.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.8 124.66 39.92 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 108.121 -1.066 . . . . 57.13 108.121 -168.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -116.95 143.95 45.13 Favored 'General case' 0 C--O 1.197 -1.693 0 N-CA-C 105.892 -1.892 . . . . 47.54 105.892 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 90.8 mmm -118.9 151.76 37.53 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 116.731 -1.604 . . . . 62.21 107.606 171.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -114.5 150.74 34.39 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 115.825 -2.036 . . . . 38.41 108.686 162.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -167.18 161.38 14.49 Favored 'General case' 0 C--O 1.195 -1.766 0 CA-C-O 126.823 3.201 . . . . 33.63 109.511 -170.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . 0.252 10.8 t -96.55 138.85 33.5 Favored 'General case' 0 C--N 1.277 -2.56 0 CA-C-N 112.136 -2.302 . . . . 31.48 107.859 169.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 68.1 p -105.67 5.43 31.1 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.037 -1.465 . . . . 26.06 110.978 177.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -60.25 140.48 91.34 Favored Pre-proline 0 C--O 1.271 2.188 0 N-CA-C 104.204 -2.517 . . . . 36.87 104.204 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.41 114.47 1.57 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.43 3.42 . . . . 39.85 115.584 -173.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.5 5.1 75.79 Favored Glycine 1 C--O 1.152 -4.983 2 O-C-N 129.784 4.427 . . . . 43.62 106.924 167.439 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -75.76 -29.71 58.91 Favored 'General case' 1 C--O 1.309 4.198 0 CA-C-N 120.068 1.934 . . . . 41.12 109.976 -171.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.7 p -62.01 -23.41 66.42 Favored 'General case' 0 C--O 1.267 1.975 0 C-N-CA 127.688 2.395 . . . . 44.61 110.777 -171.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.23 -46.85 85.04 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 124.742 1.276 . . . . 63.25 107.724 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.68 11.94 Favored 'General case' 0 N--CA 1.498 1.975 0 CA-C-N 119.748 1.158 . . . . 69.92 112.093 177.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 71.4 mtp -94.84 80.26 3.71 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.985 -1.117 . . . . 44.8 107.985 -165.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.87 172.81 17.41 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 114.652 -2.594 . . . . 64.93 106.891 176.606 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 176.91 177.15 45.63 Favored Glycine 0 C--O 1.281 3.086 0 C-N-CA 127.602 2.525 . . . . 43.48 107.105 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 40.2 p -101.17 145.51 28.7 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 126.53 1.932 . . . . 50.85 107.113 -171.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 6.0 tt -127.6 123.26 35.26 Favored 'General case' 0 C--O 1.186 -2.244 0 N-CA-C 107.14 -1.43 . . . . 43.69 107.14 170.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.8 m -124.4 138.57 54.35 Favored 'General case' 0 C--O 1.286 3.007 0 O-C-N 123.734 0.646 . . . . 61.6 109.846 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -87.18 104.04 15.99 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 114.556 -2.64 . . . . 66.62 108.521 166.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.518 2.955 0 C-N-CA 127.185 2.194 . . . . 90.14 110.61 -173.776 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.413 0 CA-C-O 117.458 -1.258 . . . . 84.19 108.097 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 81.5 m 60.28 27.49 17.04 Favored 'General case' 1 C--O 1.326 5.099 0 C-N-CA 125.1 1.36 . . . . 83.38 113.257 164.893 -60.221 -64.521 -94.691 102.557 2.071 106.087 -78.153 -65.99 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 62.1 p -140.72 168.78 18.98 Favored 'General case' 0 C--O 1.181 -2.53 0 O-C-N 123.511 0.507 . . . . 65.81 110.096 173.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.0 p -150.51 141.24 16.43 Favored 'Isoleucine or valine' 0 C--O 1.268 2.039 0 N-CA-C 105.884 -1.895 . . . . 52.79 105.884 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -101.51 119.4 38.71 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 127.093 2.745 . . . . 70.19 107.292 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 17.9 tt -127.68 143.02 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 119.043 0.838 . . . . 45.04 110.262 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -118.84 142.53 47.65 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 125.295 1.438 . . . . 56.51 107.659 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.29 124.35 5.89 Favored Glycine 0 C--O 1.282 3.151 0 N-CA-C 105.928 -2.869 . . . . 48.88 105.928 171.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASN . . . . . 0.464 ' O ' ' NE2' ' B' ' 46' ' ' HIS . 37.5 p30 -109.35 -174.13 2.43 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.19 1.995 . . . . 52.23 109.092 -172.566 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -67.59 -18.34 64.95 Favored 'General case' 0 C--O 1.274 2.351 0 C-N-CA 130.195 3.398 . . . . 73.47 113.249 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -86.4 10.73 14.2 Favored 'General case' 0 N--CA 1.514 2.727 0 N-CA-C 116.416 2.006 . . . . 84.29 116.416 165.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' MET . . . . . 0.416 ' CA ' ' CE ' ' B' ' 44' ' ' MET . 48.3 ttm 67.66 43.98 1.74 Allowed 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 105.029 -2.212 . . . . 70.47 105.029 172.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -124.17 153.19 41.92 Favored 'General case' 0 C--O 1.186 -2.258 0 CA-C-N 115.357 -0.838 . . . . 64.42 111.866 173.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -101.23 151.97 21.22 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 104.205 -2.517 . . . . 44.2 104.205 165.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 29.1 p-10 -87.86 7.31 31.3 Favored 'General case' 0 C--O 1.3 3.75 0 O-C-N 120.681 -1.262 . . . . 45.15 107.922 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 5.2 t -146.35 152.01 38.42 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 116.797 -1.573 . . . . 42.56 108.053 172.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -117.96 5.39 12.12 Favored 'General case' 0 C--O 1.16 -3.655 0 CA-C-O 115.385 -2.245 . . . . 47.89 112.012 173.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.07 113.88 1.05 Allowed 'General case' 1 C--O 1.308 4.183 0 CA-C-O 125.113 2.387 . . . . 46.73 111.354 -167.079 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 60.9 mt -114.3 131.79 65.27 Favored 'Isoleucine or valine' 0 C--O 1.25 1.093 0 CA-C-N 112.736 -2.029 . . . . 48.1 107.915 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 69.5 p -115.27 118.93 34.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 126.911 2.632 . . . . 58.34 106.723 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 92.3 t -102.3 108.44 23.96 Favored 'Isoleucine or valine' 0 C--O 1.288 3.11 0 O-C-N 126.26 2.225 . . . . 66.41 107.568 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -48.26 127.07 12.2 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 117.87 -1.062 . . . . 90.59 112.182 168.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -13.8 61.73 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 124.836 1.254 . . . . 106.7 110.706 -177.253 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.6 p -78.3 -23.54 47.09 Favored 'General case' 0 C--O 1.258 1.516 0 C-N-CA 126.158 1.783 . . . . 86.62 110.141 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.79 134.38 55.16 Favored 'General case' 0 C--O 1.287 3.042 0 CA-C-N 120.075 1.307 . . . . 86.17 108.49 176.161 -65.99 -78.153 -94.691 106.087 2.071 102.557 -64.521 -60.221 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -89.5 -31.03 17.85 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 115.956 -1.973 . . . . 93.77 107.351 168.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -123.67 144.39 49.67 Favored 'General case' 0 C--O 1.18 -2.579 0 CA-C-O 113.862 -2.97 . . . . 77.57 112.238 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . 0.255 61.7 t80 -126.66 131.47 51.42 Favored 'General case' 0 N--CA 1.507 2.409 0 CA-C-N 121.882 2.128 . . . . 54.74 106.973 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 40.5 m -113.83 131.98 56.05 Favored 'General case' 0 C--O 1.178 -2.683 0 CA-C-O 122.86 1.314 . . . . 54.17 108.402 -177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -110.07 127.61 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 C-N-CA 124.869 1.268 . . . . 43.01 109.542 168.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -109.06 106.46 16.4 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 115.293 -2.289 . . . . 48.28 108.808 171.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -94.13 132.58 38.51 Favored 'General case' 0 C--O 1.283 2.826 0 O-C-N 128.689 3.743 . . . . 42.26 108.559 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 56.6 p -126.36 157.58 38.11 Favored 'General case' 0 CA--C 1.555 1.154 0 O-C-N 125.363 1.665 . . . . 45.23 109.643 167.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -113.66 96.9 42.35 Favored Pre-proline 0 C--O 1.254 1.33 0 O-C-N 127.15 2.781 . . . . 56.29 110.828 170.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PRO . . . . . 0.523 ' O ' ' O ' ' B' ' 37' ' ' GLY . 42.5 Cg_endo -70.6 -170.6 0.46 Allowed 'Trans proline' 0 C--N 1.377 2.046 0 CA-C-N 122.647 1.981 . . . . 58.65 112.016 161.009 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLY . . . . . 0.523 ' O ' ' O ' ' B' ' 36' ' ' PRO . . . 61.01 155.2 0.04 OUTLIER Glycine 0 N--CA 1.508 3.484 0 C-N-CA 115.507 -3.235 . . . . 61.53 112.341 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -101.92 3.31 38.97 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.457 2.303 . . . . 74.18 110.518 -144.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 16.3 mt -91.92 143.21 27.4 Favored Pre-proline 0 C--O 1.246 0.897 0 C-N-CA 117.026 -1.87 . . . . 65.84 106.754 -167.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -87.73 165.2 7.61 Favored 'Trans proline' 0 C--N 1.358 1.052 0 CA-C-N 114.207 -1.033 . . . . 67.69 114.105 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -58.01 -38.52 76.32 Favored 'General case' 0 CA--C 1.596 2.719 0 O-C-N 125.54 1.775 . . . . 56.24 110.559 -161.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.92 -12.12 60.56 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 121.266 1.848 . . . . 72.08 109.73 -176.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 2.3 t -107.76 -44.04 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 CA-C-N 119.172 0.896 . . . . 70.03 109.742 -176.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' MET . . . . . 0.416 ' CE ' ' CA ' ' B' ' 13' ' ' MET . 25.9 tpp -134.19 41.47 2.96 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.633 1.173 . . . . 58.94 110.038 -173.842 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.9 133.69 52.38 Favored Glycine 1 C--O 1.297 4.044 0 CA-C-O 118.593 -1.115 . . . . 50.79 114.038 175.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' HIS . . . . . 0.464 ' NE2' ' O ' ' B' ' 10' ' ' ASN . 26.0 m-70 -125.54 145.42 50.12 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 126.229 1.782 . . . . 40.67 108.673 172.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.7 p30 -139.35 176.36 8.78 Favored 'General case' 1 C--O 1.152 -4.059 0 O-C-N 128.372 3.545 . . . . 34.62 103.102 165.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -138.8 116.31 11.3 Favored 'General case' 0 CA--C 1.474 -1.949 0 N-CA-C 102.357 -3.201 . . . . 34.93 102.357 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 58.9 t -133.28 131.92 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 127.265 2.853 . . . . 37.94 103.597 -169.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.271 49.1 tp -109.55 129.44 55.57 Favored 'General case' 0 C--O 1.178 -2.682 0 C-N-CA 126.071 1.748 . . . . 44.41 109.451 174.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 87.4 p -144.32 175.33 10.18 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.88 2.072 . . . . 47.78 107.074 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 29.5 p -62.38 153.86 29.86 Favored 'General case' 1 C--O 1.315 4.505 0 N-CA-C 109.416 -0.587 . . . . 55.68 109.416 165.172 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.52 -37.84 68.45 Favored 'General case' 0 C--O 1.284 2.918 0 N-CA-C 115.86 1.8 . . . . 56.92 115.86 167.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.03 -38.63 89.42 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-O 122.538 1.161 . . . . 64.49 111.521 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -83.72 -13.26 54.42 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 113.525 -3.131 . . . . 73.45 113.7 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.4 ttt -55.56 -45.64 77.28 Favored 'General case' 0 C--N 1.366 1.294 0 CA-C-N 122.068 2.213 . . . . 53.2 111.8 -173.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLN . . . . . 0.411 ' NE2' ' CG2' ' B' ' 61' ' ' THR . 32.9 tp60 -66.28 -42.88 87.78 Favored 'General case' 0 C--O 1.271 2.202 0 CA-C-N 122.36 2.345 . . . . 77.9 109.398 -170.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.04 -46.68 93.75 Favored Glycine 0 N--CA 1.505 3.29 0 CA-C-O 119.244 -0.753 . . . . 56.99 113.567 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 94.0 t -50.88 -53.04 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 CA-C-O 115.857 -2.02 . . . . 51.42 108.867 168.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.24 -48.19 81.98 Favored 'Isoleucine or valine' 0 C--O 1.273 2.309 0 CA-C-N 121.064 1.757 . . . . 48.95 108.701 -172.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' THR . . . . . 0.411 ' CG2' ' NE2' ' B' ' 57' ' ' GLN 0.307 33.6 p -70.83 -39.06 73.21 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 116.247 -1.835 . . . . 62.51 107.154 -172.931 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.03 -32.41 73.87 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 122.315 2.325 . . . . 74.79 109.232 174.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.02 49.77 Favored Glycine 0 C--O 1.196 -2.273 0 O-C-N 120.543 -1.348 . . . . 54.33 113.815 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' MET . . . . . 0.518 ' SD ' ' CE ' ' A' ' 64' ' ' MET . 66.3 ttp -61.8 -37.43 84.35 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 123.145 0.578 . . . . 93.75 110.091 -179.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -27.6 68.98 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 118.627 0.649 . . . . 66.78 109.931 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -24.02 30.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 116.292 -1.813 . . . . 62.99 112.781 -174.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.24 170.38 46.11 Favored Glycine 0 C--O 1.201 -1.935 0 O-C-N 124.371 1.044 . . . . 57.01 114.091 172.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 26.3 tp -58.49 -31.82 68.22 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 126.672 1.989 . . . . 60.79 110.891 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.55 -41.64 54.29 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-O 115.686 -2.102 . . . . 103.9 107.623 179.9 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm -109.03 32.46 4.91 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.128 2.571 . . . . 60.4 113.253 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 53.49 29.43 9.0 Favored 'General case' 0 N--CA 1.513 2.724 0 CA-C-N 120.637 1.562 . . . . 52.57 115.067 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 50.77 45.66 26.91 Favored 'General case' 0 C--O 1.267 2.0 0 C-N-CA 123.974 0.91 . . . . 48.45 112.997 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 18.4 mt -143.73 136.39 27.23 Favored 'General case' 0 C--O 1.156 -3.848 0 O-C-N 125.567 1.792 . . . . 53.03 108.847 176.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -78.91 130.37 70.35 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 101.713 -3.44 . . . . 59.92 101.713 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -55.38 128.28 29.77 Favored 'Trans proline' 0 C--O 1.283 2.755 0 C-N-CA 123.32 2.68 . . . . 64.98 112.442 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 55.9 27.56 11.24 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 126.043 2.09 . . . . 87.04 113.189 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -41.65 110.62 0.17 Allowed 'General case' 0 C--O 1.254 1.339 0 C-N-CA 126.344 1.858 . . . . 59.96 106.79 155.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 91.7 p -71.9 -6.84 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 124.366 1.041 . . . . 66.36 111.094 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -85.04 -14.38 47.51 Favored 'General case' 0 CA--C 1.557 1.246 0 O-C-N 120.213 -1.555 . . . . 61.7 107.578 -176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' VAL . . . . . . . . . . . . . 87.7 t -84.67 111.83 20.93 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.897 0 CA-C-O 122.693 1.235 . . . . 58.41 109.283 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 97.1 mt -71.24 -41.3 74.85 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.498 0 C-N-CA 114.866 -2.734 . . . . 69.44 109.361 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -164.78 151.3 10.64 Favored 'General case' 0 C--O 1.261 1.702 0 CA-C-N 120.255 1.388 . . . . 55.4 107.369 -172.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -160.61 149.31 16.68 Favored 'General case' 0 C--O 1.263 1.796 0 CA-C-O 115.669 -2.11 . . . . 44.58 108.996 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.8 p -80.87 170.47 16.23 Favored 'General case' 0 C--O 1.182 -2.496 0 O-C-N 126.714 2.509 . . . . 42.08 112.289 160.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.4 mttp -58.54 155.46 12.23 Favored 'General case' 0 C--O 1.171 -3.051 0 C-N-CA 129.755 3.222 . . . . 72.4 106.885 163.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -81.55 133.31 35.37 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 125.739 1.899 . . . . 44.99 106.076 165.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 22.3 pt -134.81 146.4 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 105.877 -1.898 . . . . 47.86 105.877 -170.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . -109.13 -178.19 21.43 Favored Glycine 0 CA--C 1.537 1.423 0 O-C-N 125.803 1.94 . . . . 57.08 113.128 164.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 16.8 t -28.26 130.31 0.06 Allowed 'General case' 0 C--O 1.275 2.415 0 C-N-CA 127.125 2.17 . . . . 65.67 111.539 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.23 -21.7 23.21 Favored Glycine 0 C--N 1.351 1.365 0 CA-C-O 116.257 -2.413 . . . . 59.81 111.754 172.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -92.4 171.15 9.23 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-N 120.387 2.093 . . . . 64.14 112.442 -168.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.89 166.58 28.14 Favored 'General case' 0 C--O 1.153 -3.975 0 O-C-N 119.681 -1.887 . . . . 60.28 111.504 169.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -164.38 156.15 16.12 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.498 -1.667 . . . . 57.87 106.498 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . 0.279 0.3 OUTLIER -135.26 153.89 51.75 Favored 'General case' 0 C--O 1.184 -2.373 0 CA-C-N 111.949 -2.387 . . . . 53.47 107.53 -165.727 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.22 139.28 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 N-CA-C 107.251 -1.389 . . . . 47.22 107.251 173.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 90.9 m -118.51 141.84 48.17 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 127.565 3.041 . . . . 56.38 106.151 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -144.52 158.55 43.71 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 126.561 2.413 . . . . 59.67 106.454 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.1 124.93 28.63 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 126.14 2.15 . . . . 92.51 108.214 176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.69 -25.86 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 125.265 1.426 . . . . 78.67 108.395 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 84.8 p -54.79 -27.1 39.04 Favored 'General case' 0 C--O 1.179 -2.647 0 C-N-CA 125.211 1.404 . . . . 88.89 111.43 171.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -70.1 -13.64 62.3 Favored 'General case' 0 C--O 1.194 -1.82 0 CA-C-O 115.352 -2.261 . . . . 92.71 110.7 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 54.5 mt -99.86 144.45 28.91 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-N 119.985 1.266 . . . . 86.31 110.078 177.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 30.5 mtpt -135.55 143.01 45.47 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 114.646 -2.597 . . . . 111.0 108.483 -173.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.53 146.58 51.4 Favored 'General case' 0 C--O 1.292 3.333 0 O-C-N 126.3 2.25 . . . . 116.96 108.305 -170.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 60.58 18.64 52.32 Favored Glycine 0 C--O 1.287 3.462 0 O-C-N 125.283 1.614 . . . . 92.24 114.802 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -97.43 147.7 23.95 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 106.041 -1.837 . . . . 87.27 106.041 156.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -96.06 126.11 41.06 Favored 'General case' 1 C--O 1.323 4.96 0 CA-C-O 115.858 -2.02 . . . . 69.16 106.938 -175.946 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -110.72 140.83 44.76 Favored 'General case' 0 C--O 1.175 -2.817 0 O-C-N 126.631 2.457 . . . . 69.31 110.752 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' MET . . . . . . . . . . . . . 92.7 mmm -122.05 139.19 54.01 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 105.887 -1.894 . . . . 56.64 105.887 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . 0.256 12.8 p90 -101.7 149.02 24.57 Favored 'General case' 0 C--O 1.167 -3.247 0 O-C-N 124.328 1.017 . . . . 39.92 109.317 162.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -163.88 159.6 21.21 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 108.108 -1.071 . . . . 38.44 108.108 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' CYS . . . . . . . . . . . . . 37.0 t -94.81 136.36 35.21 Favored 'General case' 0 C--O 1.187 -2.205 0 CA-C-O 115.977 -1.963 . . . . 40.17 108.266 167.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 77.6 p -103.72 9.96 36.92 Favored 'General case' 0 C--O 1.184 -2.388 0 C-N-CA 127.996 2.518 . . . . 39.46 110.361 -175.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -64.51 142.69 98.48 Favored Pre-proline 0 C--N 1.306 -1.305 0 N-CA-C 104.279 -2.489 . . . . 43.46 104.279 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -56.64 109.04 0.39 Allowed 'Trans proline' 0 C--O 1.19 -1.911 0 C-N-CA 122.608 2.205 . . . . 46.88 114.862 -176.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.59 7.32 56.88 Favored Glycine 1 C--O 1.306 4.6 2 C-N-CA 135.806 6.431 . . . . 48.35 110.594 168.007 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -82.23 -18.45 42.49 Favored 'General case' 1 C--O 1.141 -4.652 0 C-N-CA 115.309 -2.557 . . . . 53.09 110.572 -171.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.7 p -73.28 -21.81 60.52 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 118.623 -2.548 . . . . 68.77 108.759 -168.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -51.96 -59.81 3.91 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 121.302 1.864 . . . . 62.23 109.861 169.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 1.5 mt -87.45 -32.79 19.31 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 117.282 -1.342 . . . . 60.27 111.294 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' MET . . . . . 0.413 ' SD ' ' CE1' ' B' ' 46' ' ' HIS . 96.0 mtp -100.24 80.5 2.27 Favored 'General case' 1 C--O 1.091 -7.263 0 N-CA-C 105.419 -2.067 . . . . 47.09 105.419 -161.019 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.91 159.88 37.02 Favored 'General case' 0 CA--C 1.497 -1.058 0 N-CA-C 106.908 -1.515 . . . . 67.13 106.908 -178.335 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.51 -170.58 34.19 Favored Glycine 0 C--O 1.214 -1.097 0 O-C-N 126.793 2.558 . . . . 44.66 108.128 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 41.0 p -99.56 143.47 29.76 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 126.547 1.939 . . . . 51.12 107.289 -174.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 4.5 tt -124.29 120.42 32.14 Favored 'General case' 0 CA--C 1.488 -1.415 0 O-C-N 124.724 1.265 . . . . 51.35 108.349 166.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -123.98 144.02 50.06 Favored 'General case' 1 C--O 1.309 4.215 0 O-C-N 127.359 2.912 . . . . 63.41 111.413 -173.021 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.53 97.57 7.88 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 109.428 -3.533 . . . . 89.54 111.524 171.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.301 3.793 1 CA-C-O 134.253 6.739 . . . . 96.58 106.979 -173.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.548 4.474 0 N-CA-C 109.654 -0.499 . . . . 64.45 109.654 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 m 55.12 19.5 2.85 Favored 'General case' 0 N--CA 1.513 2.7 0 N-CA-C 115.576 1.695 . . . . 73.67 115.576 175.78 -53.007 -56.867 -86.667 106.482 2.111 103.885 -83.395 -60.53 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' SER . . . . . . . . . . . . . 80.5 p -136.11 170.86 15.33 Favored 'General case' 0 C--O 1.195 -1.777 0 CA-C-N 120.466 1.485 . . . . 55.55 110.397 168.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' VAL . . . . . . . . . . . . . 14.4 p -150.65 140.93 16.14 Favored 'Isoleucine or valine' 0 C--O 1.272 2.277 0 N-CA-C 104.368 -2.456 . . . . 61.9 104.368 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -104.14 119.37 38.8 Favored 'General case' 0 C--O 1.256 1.395 0 O-C-N 126.387 2.305 . . . . 89.51 106.124 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ILE . . . . . . . . . . . . . 50.2 mt -129.48 144.19 38.84 Favored 'Isoleucine or valine' 0 C--O 1.164 -3.398 0 CA-C-N 119.38 0.991 . . . . 73.38 109.047 -175.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -123.63 136.16 54.34 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 102.369 -3.197 . . . . 75.57 102.369 -173.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.33 130.6 9.68 Favored Glycine 0 C--O 1.26 1.744 0 O-C-N 128.437 3.586 . . . . 71.14 107.703 159.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ASN . . . . . 0.445 ' O ' ' NE2' ' C' ' 46' ' ' HIS . 52.2 p30 -110.33 -171.89 1.92 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 119.126 1.463 . . . . 72.73 110.022 -174.104 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -68.73 -10.74 58.25 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 126.418 2.324 . . . . 105.84 113.638 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -103.95 16.7 25.71 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 122.225 2.284 . . . . 92.28 110.705 173.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' MET . . . . . . . . . . . . . 3.2 ttm 65.34 41.09 4.48 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.957 -1.127 . . . . 83.3 107.957 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -119.37 129.71 54.96 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 125.014 1.326 . . . . 75.16 109.472 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -83.86 146.86 27.86 Favored 'General case' 0 C--O 1.166 -3.311 0 N-CA-C 107.197 -1.409 . . . . 60.46 107.197 162.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -78.44 11.57 2.39 Favored 'General case' 0 C--O 1.176 -2.8 0 CA-C-N 120.818 1.645 . . . . 72.53 108.212 -178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' THR . . . . . . . . . . . . . 3.7 t -156.62 154.61 30.45 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 106.851 -1.537 . . . . 65.22 106.851 172.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 53.6 p30 -131.95 17.75 4.63 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 125.593 1.808 . . . . 85.39 108.491 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -160.73 130.33 4.97 Favored 'General case' 0 C--O 1.159 -3.693 0 CA-C-O 117.093 -1.432 . . . . 58.61 111.9 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ILE . . . . . . . . . . . . . 79.5 mt -125.35 140.36 48.52 Favored 'Isoleucine or valine' 0 C--O 1.281 2.737 0 C-N-CA 126.825 2.05 . . . . 48.48 106.733 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' THR . . . . . . . . . . . . . 81.6 p -124.81 129.38 50.32 Favored 'General case' 0 C--O 1.279 2.607 0 N-CA-C 103.282 -2.858 . . . . 67.91 103.282 179.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 62.7 t -109.09 109.33 27.97 Favored 'Isoleucine or valine' 0 C--O 1.273 2.31 0 O-C-N 126.719 2.512 . . . . 54.31 104.341 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -50.38 127.42 17.37 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 126.506 2.379 . . . . 97.75 110.018 168.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -74.14 -7.82 53.96 Favored 'General case' 0 C--O 1.275 2.409 0 CA-C-O 117.128 -1.415 . . . . 88.86 109.595 -175.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 82.7 p -74.11 -25.88 60.03 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 117.549 -1.215 . . . . 59.42 111.384 167.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' CYS . . . . . . . . . . . . . 79.4 m -63.96 132.76 51.64 Favored 'General case' 0 C--O 1.298 3.613 0 CA-C-N 119.927 1.24 . . . . 64.08 110.621 177.661 -60.53 -83.395 -86.667 103.885 2.111 106.482 -56.867 -53.007 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -90.78 -31.61 16.44 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 116.601 -1.666 . . . . 58.37 108.388 170.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -131.53 149.97 52.32 Favored 'General case' 1 C--O 1.316 4.558 0 CA-C-N 120.469 1.486 . . . . 55.6 110.631 174.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -126.0 140.35 52.68 Favored 'General case' 0 C--O 1.271 2.228 0 N-CA-C 106.219 -1.771 . . . . 47.15 106.219 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 29.7 m -119.51 135.57 54.71 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.876 1.36 . . . . 52.14 111.311 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' VAL . . . . . . . . . . . . . 28.3 t -116.28 127.11 73.98 Favored 'Isoleucine or valine' 0 C--O 1.305 3.986 0 CA-C-O 117.59 -1.195 . . . . 50.43 108.099 172.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -112.82 112.14 23.42 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 126.957 2.661 . . . . 68.87 107.505 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 24.7 tp -101.1 139.44 36.78 Favored 'General case' 1 C--O 1.346 6.143 0 O-C-N 127.125 2.765 . . . . 59.13 106.863 -178.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' SER . . . . . . . . . . . . . 4.2 p -135.4 156.5 48.83 Favored 'General case' 0 N--CA 1.503 2.189 0 CA-C-O 117.223 -1.37 . . . . 63.88 107.906 175.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -118.31 94.93 47.89 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 126.622 2.451 . . . . 80.17 109.194 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' PRO . . . . . 0.562 ' O ' ' O ' ' C' ' 37' ' ' GLY . 54.6 Cg_endo -69.06 -174.44 0.77 Allowed 'Trans proline' 0 C--N 1.368 1.565 0 CA-C-N 121.938 1.728 . . . . 94.7 112.693 160.032 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' GLY . . . . . 0.562 ' O ' ' O ' ' C' ' 36' ' ' PRO . . . 57.36 157.34 0.01 OUTLIER Glycine 0 C--O 1.271 2.421 0 O-C-N 119.522 -1.986 . . . . 99.79 111.602 -179.154 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 m-20 -99.54 9.35 43.36 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 126.077 1.751 . . . . 114.56 111.891 -148.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 mt -91.02 141.84 26.86 Favored Pre-proline 0 N--CA 1.475 0.786 0 C-N-CA 118.441 -1.304 . . . . 91.64 107.88 -170.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -80.68 161.18 21.8 Favored 'Trans proline' 0 C--O 1.201 -1.34 0 N-CA-C 116.405 1.656 . . . . 88.78 116.405 174.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -53.41 -41.37 65.94 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 128.214 2.606 . . . . 78.0 110.626 -167.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -71.81 -12.37 61.26 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 120.264 1.393 . . . . 85.45 110.306 -174.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.37 -46.12 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 C-N-CA 124.638 1.175 . . . . 94.66 109.288 -171.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' MET . . . . . . . . . . . . . 30.2 tpp -133.42 39.81 3.2 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 125.577 1.551 . . . . 96.68 108.911 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.71 139.56 46.93 Favored Glycine 0 C--O 1.285 3.343 0 O-C-N 123.174 0.296 . . . . 69.77 112.914 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' HIS . . . . . 0.445 ' NE2' ' O ' ' C' ' 10' ' ' ASN . 35.6 m-70 -129.66 141.56 50.9 Favored 'General case' 0 C--O 1.271 2.209 0 N-CA-C 107.956 -1.127 . . . . 56.33 107.956 171.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASN . . . . . . . . . . . . . 56.4 p30 -134.1 170.36 15.78 Favored 'General case' 0 C--O 1.261 1.695 0 C-N-CA 126.996 2.118 . . . . 45.31 107.563 164.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -127.08 118.9 25.32 Favored 'General case' 0 C--O 1.177 -2.726 0 CA-C-O 115.576 -2.154 . . . . 40.9 106.076 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 48.4 t -131.03 124.02 55.08 Favored 'Isoleucine or valine' 1 C--O 1.137 -4.818 0 O-C-N 126.28 2.238 . . . . 39.74 106.855 -175.403 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 31.1 tp -99.97 128.67 46.03 Favored 'General case' 0 C--N 1.282 -2.361 0 C-N-CA 127.215 2.206 . . . . 32.02 108.23 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' SER . . . . . . . . . . . . . 59.3 p -136.62 176.33 8.8 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 125.909 1.684 . . . . 34.56 108.024 162.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' THR . . . . . . . . . . . . . 30.8 p -56.97 150.7 16.25 Favored 'General case' 0 C--N 1.276 -2.602 0 C-N-CA 125.038 1.335 . . . . 39.36 108.439 158.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.52 -42.36 78.28 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-O 117.301 -1.333 . . . . 42.14 110.22 167.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.67 -41.31 81.3 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 119.595 1.088 . . . . 54.0 111.935 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -82.5 -12.99 57.41 Favored 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 117.334 2.346 . . . . 53.83 117.334 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' MET . . . . . . . . . . . . . 21.4 ttt -53.5 -52.88 58.16 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-O 116.434 -1.746 . . . . 59.51 112.589 -173.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -61.49 -36.16 79.69 Favored 'General case' 0 N--CA 1.508 2.461 0 CA-C-N 122.76 2.527 . . . . 85.3 108.78 -169.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.79 -45.98 79.02 Favored Glycine 0 C--O 1.278 2.887 0 CA-C-N 120.74 1.609 . . . . 48.77 112.095 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' VAL . . . . . . . . . . . . . 53.6 t -58.26 -48.14 85.64 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.596 0 N-CA-C 106.127 -1.805 . . . . 47.4 106.127 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.6 -48.19 85.88 Favored 'Isoleucine or valine' 0 C--O 1.29 3.201 0 CA-C-N 121.881 2.128 . . . . 52.67 110.01 -171.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' THR . . . . . . . . . . . . 0.3 40.0 p -70.32 -40.49 74.14 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 114.392 -2.718 . . . . 72.55 108.134 -174.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -64.67 -39.23 93.32 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 107.156 -1.424 . . . . 67.86 107.156 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.93 -43.75 81.5 Favored Glycine 0 N--CA 1.481 1.634 0 C-N-CA 118.669 -1.729 . . . . 56.48 112.117 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' MET . . . . . . . . . . . . . 38.5 ttp -58.44 -41.16 84.47 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.683 1.242 . . . . 101.0 108.975 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.29 -27.87 67.64 Favored 'General case' 0 C--O 1.196 -1.734 0 O-C-N 124.513 1.133 . . . . 70.97 111.061 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.25 -25.23 27.4 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 121.215 1.825 . . . . 67.48 112.554 -173.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.32 172.14 47.76 Favored Glycine 0 N--CA 1.476 1.313 0 CA-C-O 117.803 -1.554 . . . . 62.74 113.84 164.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' LEU . . . . . . . . . . . . . 30.0 tp -59.44 -35.29 73.76 Favored 'General case' 0 C--O 1.292 3.302 0 C-N-CA 126.628 1.971 . . . . 71.03 110.97 -167.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -50.43 -47.8 56.56 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 127.621 3.075 . . . . 101.89 109.498 178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -96.24 17.77 15.11 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 126.801 2.04 . . . . 75.64 110.405 -167.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 60.32 23.55 13.01 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-O 117.293 -1.337 . . . . 75.1 109.386 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 61.41 43.27 10.64 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.904 1.377 . . . . 56.94 109.006 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 mt -133.88 142.58 47.84 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-O 116.776 -1.583 . . . . 53.66 109.515 167.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -57.1 123.88 62.57 Favored Pre-proline 0 C--O 1.206 -1.195 0 O-C-N 127.187 2.804 . . . . 85.29 106.861 165.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -46.28 132.97 15.55 Favored 'Trans proline' 0 C--O 1.273 2.244 0 C-N-CA 124.503 3.469 . . . . 76.04 112.966 163.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 52.26 26.32 3.93 Favored 'General case' 0 C--O 1.27 2.137 0 C-N-CA 125.397 1.479 . . . . 92.29 114.636 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -49.29 110.42 0.37 Allowed 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.225 -1.769 . . . . 62.68 106.225 171.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 84.7 p -67.77 -14.82 63.27 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 124.833 1.333 . . . . 62.41 110.822 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -79.34 -16.62 56.02 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 123.802 0.689 . . . . 62.98 109.911 -178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' VAL . . . . . . . . . . . . . 94.9 t -80.78 112.88 19.38 Favored 'Isoleucine or valine' 0 C--O 1.175 -2.833 0 CA-C-O 122.095 0.95 . . . . 39.19 109.665 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 87.7 mt -73.23 -42.69 58.0 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.217 0 O-C-N 119.76 -1.837 . . . . 44.8 106.671 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.75 158.35 25.65 Favored 'General case' 0 C--O 1.265 1.897 0 N-CA-C 105.319 -2.104 . . . . 32.27 105.319 -174.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -159.67 152.53 21.67 Favored 'General case' 0 C--O 1.161 -3.572 0 O-C-N 118.688 -2.508 . . . . 42.07 110.909 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' THR . . . . . . . . . . . . . 16.0 p -84.34 166.65 17.24 Favored 'General case' 0 C--O 1.187 -2.208 0 O-C-N 123.975 0.797 . . . . 42.89 110.58 161.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' LYS . . . . . . . . . . . . . 28.4 mttp -56.69 156.96 5.78 Favored 'General case' 0 C--N 1.287 -2.128 0 C-N-CA 131.105 3.762 . . . . 82.23 109.706 156.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 24.2 tp -81.88 133.16 35.3 Favored 'General case' 0 C--O 1.171 -3.062 0 CA-C-O 114.283 -2.77 . . . . 67.94 109.38 172.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' ILE . . . . . . . . . . . . . 5.8 pt -133.32 145.28 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 125.166 1.541 . . . . 65.98 110.786 -170.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.96 178.86 18.97 Favored Glycine 0 N--CA 1.475 1.252 0 O-C-N 124.535 1.147 . . . . 76.59 113.335 168.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -34.54 129.92 0.39 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 127.51 2.324 . . . . 93.24 110.659 -172.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.22 -2.08 46.22 Favored Glycine 0 C--O 1.18 -3.265 0 CA-C-O 116.638 -2.201 . . . . 84.82 114.03 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -84.93 171.97 11.74 Favored 'General case' 0 C--O 1.268 2.078 0 CA-C-N 121.233 2.516 . . . . 82.27 110.42 173.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -150.93 154.61 37.48 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 107.363 -1.347 . . . . 87.76 107.363 170.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -153.95 158.42 40.64 Favored 'General case' 0 C--O 1.2 -1.541 0 O-C-N 125.181 1.55 . . . . 66.04 107.611 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' SER . . . . . . . . . . . . . 1.9 t -140.21 146.17 38.36 Favored 'General case' 0 C--O 1.283 2.862 0 C-N-CA 125.638 1.575 . . . . 58.62 107.262 -163.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.21 144.07 21.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 106.225 -1.769 . . . . 45.77 106.225 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' THR . . . . . . . . . . . . . 98.1 m -125.4 142.57 51.43 Favored 'General case' 0 CA--C 1.486 -1.501 0 N-CA-C 103.763 -2.681 . . . . 48.11 103.763 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -143.87 159.71 42.07 Favored 'General case' 0 C--O 1.278 2.575 0 O-C-N 126.23 2.206 . . . . 40.2 106.598 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -79.11 125.52 29.52 Favored 'General case' 1 C--O 1.333 5.454 0 O-C-N 126.331 2.269 . . . . 68.88 108.517 174.86 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . . 43.3 t -52.65 -27.93 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 C-N-CA 124.679 1.191 . . . . 44.97 112.753 166.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' SER . . . . . . . . . . . . . 82.0 p -59.18 -22.4 60.92 Favored 'General case' 0 C--O 1.176 -2.812 0 CA-C-N 120.347 1.43 . . . . 45.61 112.743 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -71.34 -15.32 62.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 121.907 2.14 . . . . 64.78 111.673 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -98.38 156.37 16.77 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 125.392 1.477 . . . . 48.71 110.517 177.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -129.48 147.81 51.33 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-O 117.76 -1.114 . . . . 110.18 108.66 171.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.33 138.14 21.79 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 125.563 1.545 . . . . 92.82 107.955 169.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 55.25 27.8 47.85 Favored Glycine 1 C--O 1.317 5.31 0 C-N-CA 126.706 2.098 . . . . 62.42 115.619 177.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' GLU . . . . . . . . . . . . 0.268 20.1 tp10 -100.24 149.47 23.54 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 106.375 -1.713 . . . . 72.97 106.375 162.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -97.13 127.91 43.54 Favored 'General case' 0 C--O 1.291 3.259 0 O-C-N 119.896 -1.752 . . . . 49.06 110.697 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.95 147.77 45.01 Favored 'General case' 0 C--O 1.284 2.895 0 N-CA-C 105.958 -1.867 . . . . 37.57 105.958 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' MET . . . . . . . . . . . . . 68.4 mmm -127.31 147.13 50.25 Favored 'General case' 0 C--O 1.278 2.571 0 N-CA-C 104.535 -2.395 . . . . 61.95 104.535 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.13 149.42 35.66 Favored 'General case' 0 C--O 1.182 -2.451 0 N-CA-C 103.803 -2.666 . . . . 45.24 103.803 169.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -162.83 157.02 20.86 Favored 'General case' 0 C--O 1.3 3.742 0 CA-C-O 127.909 3.718 . . . . 38.64 107.195 -175.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' CYS . . . . . . . . . . . . . 43.5 t -84.12 134.97 34.57 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 112.26 -2.246 . . . . 53.66 108.509 162.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' THR . . . . . . . . . . . . . 57.6 p -104.13 9.89 36.09 Favored 'General case' 0 C--O 1.289 3.183 0 CA-C-N 120.255 1.389 . . . . 43.3 109.53 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -56.01 136.15 73.63 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 106.742 -1.577 . . . . 50.39 106.742 168.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -55.46 116.64 3.29 Favored 'Trans proline' 0 C--O 1.294 3.29 0 C-N-CA 123.383 2.722 . . . . 55.38 115.109 -170.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' GLY . . . . . . . . . . . . . . . 81.82 6.53 88.93 Favored Glycine 0 C--N 1.356 1.69 1 O-C-N 129.863 4.477 . . . . 65.84 110.548 173.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -78.1 -24.61 47.48 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.692 1.246 . . . . 63.44 108.164 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' SER . . . . . . . . . . . . . 14.2 p -68.77 -18.97 64.3 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-O 117.824 -1.084 . . . . 63.95 109.911 -170.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.9 -48.03 72.84 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 105.831 -1.914 . . . . 69.86 105.831 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.42 -45.38 11.91 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 116.43 -1.748 . . . . 95.86 111.07 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' MET . . . . . . . . . . . . . 55.1 mtp -97.53 82.88 3.15 Favored 'General case' 0 C--O 1.284 2.914 0 N-CA-C 105.963 -1.865 . . . . 70.47 105.963 -159.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.01 171.54 16.68 Favored 'General case' 0 C--O 1.201 -1.477 0 N-CA-C 106.087 -1.82 . . . . 72.81 106.087 174.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.34 -172.57 40.34 Favored Glycine 0 C--N 1.289 -2.064 0 N-CA-C 108.99 -1.644 . . . . 46.9 108.99 168.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' THR . . . . . . . . . . . . . 23.9 p -101.09 150.48 22.87 Favored 'General case' 0 C--O 1.282 2.79 0 C-N-CA 125.533 1.533 . . . . 44.8 107.843 -172.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 tt -133.98 125.1 27.46 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 104.168 -2.53 . . . . 47.88 104.168 171.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' THR . . . . . . . . . . . . . 6.4 m -124.02 136.76 54.49 Favored 'General case' 1 C--O 1.312 4.371 0 CA-C-O 117.346 -1.311 . . . . 54.39 110.961 -178.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.98 104.05 12.89 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 114.238 -2.791 . . . . 54.7 109.175 165.561 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.899 0 O-C-N 127.155 2.785 . . . . 92.56 111.039 -172.862 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 N-CA-C 107.297 -1.371 . . . . 110.22 107.297 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' CYS . . . . . . . . . . . . . 60.4 m 63.31 30.56 15.63 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 124.91 1.284 . . . . 106.13 113.983 160.272 -55.717 -69.604 -88.108 103.311 2.054 104.163 -78.661 -62.31 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' SER . . . . . . . . . . . . . 19.3 p -138.25 169.3 18.03 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 119.142 0.883 . . . . 84.79 111.732 168.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.23 144.55 18.13 Favored 'Isoleucine or valine' 1 C--O 1.327 5.145 0 N-CA-C 107.408 -1.33 . . . . 65.13 107.408 167.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -100.82 122.07 42.78 Favored 'General case' 0 C--O 1.193 -1.898 0 N-CA-C 107.344 -1.354 . . . . 79.91 107.344 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ILE . . . . . . . . . . . . . 55.2 mt -122.87 156.56 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.597 0 CA-C-O 122.683 1.23 . . . . 66.18 108.796 175.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' GLN . . . . . . . . . . . . 0.286 43.8 mt-30 -129.54 146.39 51.37 Favored 'General case' 1 C--O 1.345 6.089 0 C-N-CA 129.79 3.236 . . . . 74.16 109.121 175.577 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 131.45 7.77 Favored Glycine 0 C--O 1.267 2.218 0 CA-C-N 110.308 -3.133 . . . . 56.9 108.379 170.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ASN . . . . . 0.444 ' O ' ' NE2' ' D' ' 46' ' ' HIS . 56.6 p30 -112.39 -172.46 2.05 Favored 'General case' 0 C--O 1.288 3.104 0 O-C-N 124.696 0.88 . . . . 62.28 108.819 -173.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -70.77 -12.51 61.6 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 129.075 2.95 . . . . 80.89 111.728 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -103.34 16.74 25.75 Favored 'General case' 0 C--O 1.277 2.52 0 CA-C-O 116.268 -1.825 . . . . 77.87 110.411 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' MET . . . . . . . . . . . . . 36.0 ttm 58.71 42.75 19.75 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-N 119.837 1.198 . . . . 60.84 111.231 175.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -120.43 133.71 55.38 Favored 'General case' 1 C--O 1.305 4.009 0 C-N-CA 126.496 1.918 . . . . 70.47 109.304 175.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -83.46 161.56 21.25 Favored 'General case' 0 C--O 1.172 -3.026 0 CA-C-O 117.083 -1.437 . . . . 53.87 107.773 158.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -89.88 10.21 24.66 Favored 'General case' 0 N--CA 1.524 3.231 0 N-CA-C 106.165 -1.791 . . . . 61.23 106.165 -174.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' THR . . . . . . . . . . . . . 1.7 t -165.12 156.77 15.0 Favored 'General case' 1 C--O 1.382 8.064 0 N-CA-C 104.62 -2.363 . . . . 58.31 104.62 -175.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -133.29 15.16 4.14 Favored 'General case' 0 C--O 1.255 1.369 0 C-N-CA 126.115 1.766 . . . . 88.5 108.934 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -154.65 131.66 10.92 Favored 'General case' 0 C--O 1.183 -2.42 0 CA-C-O 115.192 -2.337 . . . . 59.89 112.764 174.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ILE . . . . . . . . . . . . . 60.0 mt -125.67 131.71 71.7 Favored 'Isoleucine or valine' 0 C--O 1.303 3.91 0 C-N-CA 126.046 1.739 . . . . 57.84 107.688 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' THR . . . . . . . . . . . . . 70.4 p -117.01 129.43 56.02 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 125.78 1.925 . . . . 73.68 106.57 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' VAL . . . . . . . . . . . . . 93.1 t -118.92 106.74 20.03 Favored 'Isoleucine or valine' 0 C--O 1.304 3.957 0 N-CA-C 103.492 -2.781 . . . . 59.15 103.492 -173.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.92 126.62 18.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 127.427 2.955 . . . . 98.56 110.814 169.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -15.48 59.74 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.443 1.897 . . . . 105.95 110.349 -178.018 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' SER . . . . . . . . . . . . . 85.4 p -80.37 -22.34 41.44 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.842 1.657 . . . . 102.97 109.868 177.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' CYS . . . . . 0.456 ' O ' ' O ' ' D' ' 301' ' ' HOH . 71.4 m -62.76 132.82 53.5 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-N 119.996 1.271 . . . . 99.86 108.437 172.458 -62.31 -78.661 -88.108 104.163 2.054 103.311 -69.604 -55.717 2 2 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -31.35 18.75 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 117.022 -1.466 . . . . 100.74 108.778 173.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 -128.69 146.17 50.96 Favored 'General case' 0 C--O 1.256 1.406 0 C-N-CA 124.426 1.09 . . . . 57.79 110.874 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -123.81 142.63 50.93 Favored 'General case' 0 C--O 1.263 1.764 0 CA-C-N 121.919 2.145 . . . . 57.98 107.711 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 13.8 m -117.87 134.36 55.01 Favored 'General case' 1 C--O 1.131 -5.173 0 N-CA-C 115.374 1.62 . . . . 58.88 115.374 -179.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -117.49 131.35 70.47 Favored 'Isoleucine or valine' 0 C--O 1.273 2.298 0 N-CA-C 106.855 -1.535 . . . . 55.23 106.855 173.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -113.15 110.53 20.58 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 105.219 -2.141 . . . . 57.71 105.219 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' LEU . . . . . . . . . . . . . 11.6 tp -104.82 143.53 33.01 Favored 'General case' 1 C--O 1.309 4.189 0 O-C-N 120.313 -1.492 . . . . 61.47 108.67 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' SER . . . . . . . . . . . . . 53.4 p -147.74 157.52 43.58 Favored 'General case' 0 C--O 1.266 1.966 0 C-N-CA 125.295 1.438 . . . . 73.95 109.355 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -116.34 96.14 47.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 128.151 2.581 . . . . 74.18 111.277 -177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' PRO . . . . . 0.585 ' O ' ' O ' ' D' ' 37' ' ' GLY . 18.8 Cg_endo -63.45 -170.93 0.12 Allowed 'Trans proline' 0 C--O 1.182 -2.293 0 C-N-CA 122.577 2.184 . . . . 94.41 114.369 155.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' D' ' 36' ' ' PRO . . . 56.15 160.23 0.01 OUTLIER Glycine 0 C--O 1.282 3.104 0 O-C-N 118.733 -2.48 . . . . 104.01 111.37 178.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -99.36 6.72 46.02 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 127.419 2.287 . . . . 101.87 110.901 -153.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 23.7 mt -94.64 141.51 23.5 Favored Pre-proline 0 C--O 1.213 -0.853 0 C-N-CA 117.015 -1.874 . . . . 99.25 107.91 -166.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -79.4 163.88 24.33 Favored 'Trans proline' 0 C--O 1.199 -1.469 0 C-N-CA 122.796 2.331 . . . . 97.85 117.367 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -53.87 -41.6 67.7 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 127.106 2.163 . . . . 91.73 111.689 -167.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -75.71 -12.59 60.22 Favored 'General case' 0 C--O 1.297 3.554 0 CA-C-N 121.668 2.031 . . . . 80.16 108.843 -172.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -108.2 -44.82 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 114.75 -2.548 . . . . 71.68 108.127 -173.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' MET . . . . . . . . . . . . . 28.5 tpp -134.35 41.13 2.96 Favored 'General case' 0 C--O 1.28 2.665 0 O-C-N 126.034 2.084 . . . . 61.77 109.987 -175.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.45 136.77 46.35 Favored Glycine 0 C--O 1.264 2.031 0 CA-C-N 117.819 0.281 . . . . 56.46 113.702 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' HIS . . . . . 0.444 ' NE2' ' O ' ' D' ' 10' ' ' ASN . 37.4 m-70 -127.61 149.04 50.36 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 118.293 -0.861 . . . . 48.83 109.802 172.554 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -138.27 177.37 7.93 Favored 'General case' 0 C--O 1.277 2.54 0 N-CA-C 105.679 -1.971 . . . . 35.11 105.679 160.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' TRP . . . . . . . . . . . . 0.278 67.6 t90 -126.75 120.3 29.03 Favored 'General case' 0 C--O 1.175 -2.828 0 N-CA-C 103.346 -2.835 . . . . 31.13 103.346 174.312 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' VAL . . . . . . . . . . . . . 52.0 t -132.86 129.42 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 N-CA-C 104.888 -2.264 . . . . 24.57 104.888 -173.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' LEU . . . . . . . . . . . . . 25.0 tp -100.29 131.72 46.07 Favored 'General case' 0 C--N 1.281 -2.371 0 C-N-CA 129.45 3.1 . . . . 25.9 108.578 170.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' SER . . . . . . . . . . . . . 60.5 p -145.61 174.75 10.91 Favored 'General case' 0 C--N 1.312 -1.034 0 O-C-N 125.973 2.045 . . . . 38.76 108.334 159.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' THR . . . . . . . . . . . . . 63.9 p -56.6 153.77 9.8 Favored 'General case' 1 C--O 1.314 4.453 0 C-N-CA 119.786 -0.766 . . . . 53.33 109.397 163.737 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.1 -38.92 54.63 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 117.807 -1.092 . . . . 61.52 112.501 163.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -45.06 92.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.512 1.125 . . . . 63.26 111.85 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -85.7 -10.73 55.2 Favored 'General case' 0 C--O 1.264 1.845 0 C-N-CA 126.407 1.883 . . . . 73.02 115.299 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' MET . . . . . . . . . . . . . 22.5 ttt -54.96 -50.25 69.37 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 116.97 -1.49 . . . . 49.29 110.876 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -34.89 79.26 Favored 'General case' 0 N--CA 1.507 2.394 0 CA-C-N 122.763 2.528 . . . . 70.98 110.236 -171.709 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' GLY . . . . . 0.468 ' CA ' ' NH2' ' D' ' 79' ' ' ARG . . . -64.99 -45.72 91.45 Favored Glycine 0 C--O 1.277 2.833 0 CA-C-N 121.778 2.081 . . . . 47.58 113.08 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' VAL . . . . . . . . . . . . . 82.3 t -54.18 -47.13 67.79 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 116.488 -1.72 . . . . 39.97 107.773 173.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.03 -47.99 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 118.015 -1.474 . . . . 40.63 107.673 -171.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' THR . . . . . . . . . . . . 0.261 27.6 p -72.1 -41.86 66.78 Favored 'General case' 0 C--O 1.184 -2.362 0 CA-C-O 115.841 -2.028 . . . . 54.91 107.523 -170.292 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -57.55 -36.06 71.14 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 121.915 2.143 . . . . 64.04 112.664 166.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.35 -31.87 40.4 Favored Glycine 0 C--O 1.182 -3.148 1 C-N-CA 112.803 -4.523 . . . . 61.13 109.919 -174.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' MET . . . . . . . . . . . . . 1.3 ttm -60.67 -40.56 92.54 Favored 'General case' 0 C--O 1.199 -1.587 0 CA-C-N 121.276 2.538 . . . . 107.47 108.683 174.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.61 -29.15 69.04 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 116.623 -1.656 . . . . 94.77 110.118 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -84.41 -24.31 29.67 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 120.973 1.715 . . . . 100.57 112.345 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.13 170.85 46.22 Favored Glycine 0 C--O 1.178 -3.378 0 CA-C-O 117.778 -1.568 . . . . 79.81 112.246 163.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' LEU . . . . . . . . . . . . . 21.5 tp -57.29 -35.34 69.68 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 128.136 2.574 . . . . 96.96 109.794 -177.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -46.47 -48.64 19.02 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 126.141 2.151 . . . . 102.88 108.161 178.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 33.79 4.0 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 128.054 2.542 . . . . 117.11 111.749 -175.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 62.91 23.7 14.14 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-N 119.542 1.065 . . . . 106.07 111.797 168.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 49.15 38.1 12.37 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 124.781 1.232 . . . . 66.55 112.032 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' LEU . . . . . . . . . . . . . 21.4 mt -132.64 136.9 46.78 Favored 'General case' 0 C--O 1.268 2.046 0 C-N-CA 125.31 1.444 . . . . 55.67 109.06 166.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' LYS . . . . . . . . . . . . . 25.0 ttpt -50.54 127.47 24.39 Favored Pre-proline 0 C--N 1.317 -0.807 0 O-C-N 125.213 1.571 . . . . 83.9 107.874 162.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -50.38 128.99 24.7 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.626 2.217 . . . . 74.87 112.559 162.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 56.98 19.38 4.57 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 116.534 -1.698 . . . . 93.68 114.287 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -40.34 110.06 0.14 Allowed 'General case' 0 C--O 1.286 3.018 0 CA-C-N 120.863 1.665 . . . . 66.99 107.454 161.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' SER . . . . . . . . . . . . . 2.6 p -63.6 -21.17 66.21 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 127.845 2.458 . . . . 55.74 112.642 172.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ARG . . . . . 0.468 ' NH2' ' CA ' ' D' ' 58' ' ' GLY . 86.2 mtm180 -80.07 -13.52 59.23 Favored 'General case' 0 C--O 1.17 -3.08 0 CA-C-N 120.793 1.633 . . . . 60.19 108.608 -178.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' VAL . . . . . . . . . . . . . 93.1 t -82.32 109.4 16.29 Favored 'Isoleucine or valine' 0 C--O 1.179 -2.657 0 N-CA-C 107.577 -1.268 . . . . 38.48 107.577 -173.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' ILE . . . . . . . . . . . . . 50.0 mt -76.75 -37.36 28.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.92 0 C-N-CA 112.962 -3.495 . . . . 41.28 105.747 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' ALA . . . . . . . . . . . . . . . -159.68 147.67 17.19 Favored 'General case' 0 N--CA 1.516 2.845 0 CA-C-N 121.481 1.946 . . . . 28.19 108.371 -176.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -153.4 158.23 41.15 Favored 'General case' 0 C--N 1.288 -2.102 0 CA-C-N 121.246 1.839 . . . . 38.87 113.576 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 3.0 p -86.23 173.3 9.87 Favored 'General case' 0 C--O 1.277 2.507 0 C-N-CA 124.638 1.175 . . . . 45.8 112.909 160.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mttp -74.16 154.17 39.21 Favored 'General case' 1 C--O 1.339 5.791 0 CA-C-N 112.705 -2.043 . . . . 97.5 106.134 171.069 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' LEU . . . . . . . . . . . . . 13.1 tp -76.5 135.77 39.33 Favored 'General case' 1 C--O 1.317 4.634 0 O-C-N 128.626 3.704 . . . . 62.35 106.765 171.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' ILE . . . . . . . . . . . . . 18.9 pt -132.66 146.45 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 107.06 -1.459 . . . . 60.14 107.06 -169.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' GLY . . . . . . . . . . . . . . . -113.07 -174.17 19.02 Favored Glycine 0 CA--C 1.56 2.847 0 C-N-CA 120.382 -0.913 . . . . 62.53 113.416 156.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' SER . . . . . . . . . . . . . 3.6 t -28.76 128.5 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 128.599 2.76 . . . . 81.85 111.843 -175.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 71.7 8.84 68.63 Favored Glycine 0 C--O 1.2 -1.997 0 CA-C-O 117.022 -1.988 . . . . 87.11 112.956 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -96.49 176.3 6.08 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.121 2.46 . . . . 95.57 110.565 176.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.01 160.44 41.07 Favored 'General case' 0 C--O 1.202 -1.408 0 O-C-N 124.908 1.38 . . . . 91.08 109.985 172.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -168.58 160.26 10.73 Favored 'General case' 0 C--O 1.165 -3.37 0 O-C-N 124.3 1.0 . . . . 92.81 108.661 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' SER . . . . . . . . . . . . . 1.1 t -149.04 139.86 22.79 Favored 'General case' 1 C--O 1.32 4.815 0 CA-C-O 113.938 -2.934 . . . . 85.7 108.639 -157.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 8.4 p -142.1 141.95 28.28 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.456 1 O-C-N 129.356 4.16 . . . . 45.98 108.142 176.215 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' THR . . . . . . . . . . . . . 85.2 m -124.45 146.82 48.7 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 104.313 -2.477 . . . . 52.15 104.313 174.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -148.35 159.27 44.17 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 104.686 -2.339 . . . . 42.51 104.686 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -77.46 125.8 29.9 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 127.691 3.12 . . . . 76.53 108.42 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' VAL . . . . . . . . . . . . . 73.7 t -68.69 -24.77 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 126.213 1.805 . . . . 59.81 108.189 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' SER . . . . . . . . . . . . . 29.6 p -55.51 -28.08 52.51 Favored 'General case' 0 C--O 1.192 -1.941 0 CA-C-O 116.733 -1.603 . . . . 64.94 112.005 171.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -67.71 -18.04 64.78 Favored 'General case' 0 C--O 1.156 -3.818 0 CA-C-O 115.947 -1.978 . . . . 60.11 109.726 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 36.3 mt -98.53 152.1 19.92 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.307 1.443 . . . . 65.21 109.905 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -131.4 142.59 50.07 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.15 -1.056 . . . . 107.61 108.15 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.36 144.21 3.04 Favored 'General case' 0 C--O 1.295 3.463 0 C-N-CA 126.221 1.808 . . . . 117.69 110.539 167.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.78 -6.65 6.12 Favored Glycine 1 C--O 1.302 4.368 0 CA-C-O 117.913 -1.493 . . . . 82.66 114.986 173.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' GLU . . . . . . . . . . . . 0.263 6.0 tp10 -93.01 141.6 28.21 Favored 'General case' 0 C--O 1.183 -2.44 0 CA-C-N 119.475 1.637 . . . . 83.48 108.098 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' GLN . . . . . . . . . . . . 0.305 0.7 OUTLIER -91.87 122.53 34.48 Favored 'General case' 1 C--O 1.344 6.072 0 CA-C-O 123.956 1.836 . . . . 55.55 106.995 -176.085 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -115.12 143.4 45.28 Favored 'General case' 1 C--O 1.361 6.962 0 N-CA-C 104.444 -2.428 . . . . 51.48 104.444 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' MET . . . . . . . . . . . . . 88.9 mmm -119.03 143.98 46.79 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 104.953 -2.24 . . . . 70.66 104.953 177.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' PHE . . . . . . . . . . . . 0.278 2.4 p90 -109.57 146.7 34.25 Favored 'General case' 0 C--O 1.158 -3.733 0 N-CA-C 104.831 -2.285 . . . . 35.58 104.831 169.108 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -160.0 162.53 34.32 Favored 'General case' 0 C--O 1.172 -2.975 0 O-C-N 121.741 -0.599 . . . . 26.66 110.006 -175.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' CYS . . . . . . . . . . . . . 2.2 t -98.19 141.59 30.93 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 106.631 -1.618 . . . . 38.05 106.631 166.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' THR . . . . . . . . . . . . . 31.0 p -108.83 19.19 19.93 Favored 'General case' 0 C--O 1.195 -1.799 0 O-C-N 119.684 -1.885 . . . . 31.51 111.418 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -72.36 141.99 83.87 Favored Pre-proline 0 N--CA 1.5 2.056 0 CA-C-O 114.884 -2.484 . . . . 51.63 108.118 165.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -48.58 116.04 1.9 Allowed 'Trans proline' 1 C--O 1.314 4.307 1 C-N-CA 125.982 4.454 . . . . 46.54 115.763 -175.717 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.93 -5.67 81.93 Favored Glycine 1 C--O 1.133 -6.162 1 O-C-N 129.239 4.087 . . . . 43.07 109.336 171.192 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -83.72 -19.01 35.96 Favored 'General case' 0 C--O 1.273 2.296 0 CA-C-O 116.667 -1.635 . . . . 51.88 109.614 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' SER . . . . . . . . . . . . . 89.2 p -75.62 -16.66 60.19 Favored 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.068 -2.653 . . . . 40.54 111.067 -170.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.44 -51.89 63.75 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 105.692 -1.966 . . . . 52.32 105.692 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' LEU . . . . . . . . . . . . . 15.2 mt -83.16 -44.59 14.9 Favored 'General case' 0 C--O 1.265 1.902 0 CA-C-O 113.989 -2.91 . . . . 81.66 112.369 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' MET . . . . . . . . . . . . . 53.4 mtp -91.96 73.28 5.61 Favored 'General case' 0 C--N 1.365 1.267 0 O-C-N 126.857 2.598 . . . . 48.72 107.315 -164.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.99 171.95 14.1 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 118.274 -2.766 . . . . 73.97 109.38 173.793 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' GLY . . . . . . . . . . . . . . . -179.05 -166.83 35.64 Favored Glycine 1 C--O 1.16 -4.485 0 O-C-N 125.74 1.9 . . . . 41.1 111.427 166.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' THR . . . . . . . . . . . . . 20.9 p -99.95 149.31 23.56 Favored 'General case' 1 C--O 1.317 4.639 0 C-N-CA 128.21 2.604 . . . . 53.93 105.919 -166.235 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' LEU . . . . . . . . . . . . . 2.5 tt -141.0 109.39 5.88 Favored 'General case' 0 C--O 1.288 3.13 0 N-CA-C 103.041 -2.948 . . . . 46.85 103.041 179.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' THR . . . . . . . . . . . . . 4.3 m -120.66 136.17 54.91 Favored 'General case' 0 C--O 1.296 3.526 1 O-C-N 129.159 4.037 . . . . 61.83 112.141 -172.647 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.71 97.33 7.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 127.46 2.975 . . . . 93.41 109.434 174.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.368 0 C-N-CA 128.669 2.788 . . . . 122.06 109.573 -171.623 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 301' ' ' HOH . . . . . 0.456 ' O ' ' O ' ' D' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.899 0 N-CA-C 108.002 -1.11 . . . . 68.16 108.002 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.7 m 60.25 34.0 20.95 Favored 'General case' 0 C--O 1.276 2.468 0 C-N-CA 124.825 1.25 . . . . 57.57 113.638 175.957 -58.031 -66.683 -92.242 104.8 2.085 104.094 -79.056 -64.207 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.53 167.29 22.56 Favored 'General case' 0 C--O 1.18 -2.592 0 O-C-N 124.421 1.076 . . . . 49.84 110.754 173.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -146.93 142.3 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 104.425 -2.435 . . . . 43.63 104.425 175.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -101.11 118.7 37.51 Favored 'General case' 0 C--O 1.198 -1.642 0 O-C-N 126.333 2.27 . . . . 72.49 106.536 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.8 tt -127.4 139.78 50.95 Favored 'Isoleucine or valine' 0 C--O 1.157 -3.77 0 CA-C-N 120.864 1.666 . . . . 47.03 110.091 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -117.42 138.23 51.97 Favored 'General case' 0 C--O 1.297 3.579 0 N-CA-C 105.022 -2.214 . . . . 76.77 105.022 -177.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.66 127.2 7.6 Favored Glycine 0 N--CA 1.485 1.935 0 O-C-N 128.394 3.559 . . . . 50.76 107.503 166.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . 0.42 ' O ' ' NE2' ' A' ' 46' ' ' HIS . 56.2 p30 -109.08 -177.19 3.24 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 119.292 1.546 . . . . 75.76 109.923 -175.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.51 -9.91 10.16 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 129.368 3.067 . . . . 83.12 114.497 168.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -105.14 12.19 32.33 Favored 'General case' 0 C--O 1.276 2.483 0 CA-C-N 123.105 2.684 . . . . 85.14 110.581 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.1 ttm 70.37 41.82 0.97 Allowed 'General case' 0 C--O 1.191 -2.0 0 N-CA-C 106.342 -1.725 . . . . 69.12 106.342 166.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -123.67 133.13 53.95 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.974 1.31 . . . . 68.46 110.838 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -86.34 145.86 26.72 Favored 'General case' 1 C--O 1.118 -5.817 0 CA-C-O 115.92 -1.99 . . . . 54.38 108.132 160.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.2 p-10 -83.3 18.05 1.89 Allowed 'General case' 0 N--CA 1.51 2.526 0 CA-C-N 123.652 2.933 . . . . 59.42 107.836 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -158.39 153.58 25.56 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 116.873 -3.642 . . . . 59.76 105.849 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -138.8 10.93 2.66 Favored 'General case' 0 C--O 1.182 -2.469 0 O-C-N 124.62 1.2 . . . . 79.97 108.255 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.91 135.54 15.25 Favored 'General case' 0 C--O 1.266 1.946 0 CA-C-N 119.564 1.074 . . . . 48.47 111.283 166.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mt -123.33 132.83 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 125.524 1.529 . . . . 44.68 107.592 -178.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.338 21.2 p -112.6 123.51 50.47 Favored 'General case' 0 C--O 1.174 -2.876 0 N-CA-C 105.044 -2.206 . . . . 61.47 105.044 175.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.7 t -97.6 113.05 31.03 Favored 'Isoleucine or valine' 0 C--O 1.297 3.603 0 C-N-CA 128.235 2.614 . . . . 45.92 107.524 168.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -56.12 131.33 47.34 Favored 'General case' 0 C--O 1.283 2.852 0 O-C-N 120.695 -1.253 . . . . 74.2 108.744 172.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -12.1 61.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 117.435 -1.269 . . . . 86.18 109.594 -174.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -80.09 -20.22 45.63 Favored 'General case' 0 C--O 1.284 2.898 0 O-C-N 125.113 1.508 . . . . 71.32 109.38 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.6 m -66.67 135.82 54.62 Favored 'General case' 0 C--O 1.29 3.191 0 CA-C-N 120.127 1.331 . . . . 65.61 109.501 178.036 -64.207 -79.056 -92.242 104.094 2.085 104.8 -66.683 -58.031 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -93.03 -32.96 14.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 116.51 -1.71 . . . . 67.06 107.654 169.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -124.88 144.39 50.34 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 121.191 1.814 . . . . 67.55 111.159 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -123.71 132.41 53.82 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 121.761 2.073 . . . . 33.75 106.826 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.2 m -108.19 135.22 49.88 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.543 0.687 . . . . 44.53 111.18 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 77.5 t -105.69 134.12 48.11 Favored 'Isoleucine or valine' 0 C--O 1.285 2.947 0 O-C-N 120.486 -1.384 . . . . 33.02 108.623 162.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -112.46 108.91 18.21 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 107.768 -1.197 . . . . 47.22 107.768 171.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.59 140.59 35.67 Favored 'General case' 0 C--O 1.285 2.962 0 N-CA-C 106.163 -1.792 . . . . 45.88 106.163 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.5 p -137.2 160.8 37.96 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 116.842 -1.551 . . . . 49.15 107.745 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -114.98 96.65 45.63 Favored Pre-proline 0 N--CA 1.482 1.133 0 C-N-CA 127.347 2.259 . . . . 55.37 110.118 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' O ' ' O ' ' A' ' 37' ' ' GLY . 21.5 Cg_endo -68.15 -172.4 0.42 Allowed 'Trans proline' 0 C--O 1.255 1.371 0 CA-C-N 122.457 1.913 . . . . 64.59 113.424 161.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . 0.53 ' O ' ' O ' ' A' ' 36' ' ' PRO . . . 62.46 150.97 0.03 OUTLIER Glycine 0 N--CA 1.501 2.985 0 O-C-N 116.532 -3.855 . . . . 73.74 111.896 174.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -99.68 7.53 45.08 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 127.684 2.394 . . . . 88.49 110.633 -147.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.91 137.32 26.78 Favored Pre-proline 0 N--CA 1.511 2.611 0 C-N-CA 117.927 -1.509 . . . . 67.21 109.403 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.61 160.68 25.1 Favored 'Trans proline' 0 C--O 1.199 -1.46 0 N-CA-C 116.389 1.65 . . . . 70.9 116.389 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -53.99 -41.92 68.45 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 127.032 2.133 . . . . 62.29 111.184 -164.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -71.16 -12.38 61.45 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 117.044 -1.455 . . . . 67.32 109.504 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.1 t -111.3 -46.33 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 117.402 -1.285 . . . . 69.45 109.063 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.4 tpp -129.86 43.58 3.1 Favored 'General case' 0 C--O 1.282 2.808 0 C-N-CA 123.977 0.911 . . . . 63.55 109.945 -174.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 137.76 38.99 Favored Glycine 0 C--O 1.278 2.901 0 C-N-CA 121.121 -0.561 . . . . 45.99 114.233 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . 0.42 ' NE2' ' O ' ' A' ' 10' ' ' ASN . 42.9 m-70 -130.02 142.56 50.61 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 120.217 -0.593 . . . . 40.9 109.633 175.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -136.14 172.48 12.95 Favored 'General case' 0 C--O 1.202 -1.435 0 O-C-N 126.895 2.622 . . . . 37.53 106.96 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -125.76 120.0 29.42 Favored 'General case' 0 C--O 1.168 -3.234 1 C-N-CA 131.953 4.101 . . . . 29.52 103.063 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.8 t -132.61 130.32 59.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 O-C-N 128.422 3.576 . . . . 27.91 107.57 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.9 tp -108.62 132.49 53.84 Favored 'General case' 0 C--O 1.2 -1.541 0 N-CA-C 107.23 -1.396 . . . . 32.43 107.23 177.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 94.6 p -142.61 -179.91 6.59 Favored 'General case' 0 C--O 1.28 2.688 0 N-CA-C 106.741 -1.577 . . . . 38.99 106.741 163.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.1 p -59.62 153.74 19.28 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 124.192 0.932 . . . . 43.65 110.674 160.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.99 -44.33 78.47 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.814 0.445 . . . . 45.63 111.665 168.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.12 -43.24 73.9 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.741 0.817 . . . . 48.16 111.418 176.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -83.21 -14.4 53.4 Favored 'General case' 0 C--O 1.26 1.644 0 N-CA-C 116.276 1.954 . . . . 53.12 116.276 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 13.9 ttt -55.91 -46.3 78.45 Favored 'General case' 0 C--O 1.203 -1.373 0 CA-C-N 120.416 1.462 . . . . 53.84 110.904 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 306' ' ' HOH 0.253 1.2 pp0? -66.18 -38.51 88.2 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 123.973 3.079 . . . . 56.24 109.498 -172.589 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.75 -42.8 99.63 Favored Glycine 0 N--CA 1.504 3.198 0 N-CA-C 110.528 -1.029 . . . . 44.61 110.528 -178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.9 t -61.63 -51.24 75.17 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.391 0 N-CA-C 105.969 -1.863 . . . . 34.45 105.969 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.2 t -62.29 -48.62 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.491 0 CA-C-N 122.052 2.206 . . . . 31.66 107.741 -172.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.348 26.4 p -71.37 -34.22 70.24 Favored 'General case' 0 C--O 1.162 -3.515 0 CA-C-O 115.007 -2.425 . . . . 49.98 109.527 -173.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . 0.304 78.2 m-20 -67.34 -37.64 83.61 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-N 121.108 1.776 . . . . 44.8 108.785 173.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -63.29 -47.5 87.31 Favored Glycine 0 C--N 1.383 3.157 0 O-C-N 124.811 1.319 . . . . 37.55 112.429 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . 0.558 ' HE1' ' SD ' ' B' ' 64' ' ' MET . 24.8 ttp -57.34 -42.83 82.71 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 118.48 1.14 . . . . 62.95 110.725 176.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.74 -23.18 67.26 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 115.449 -2.215 . . . . 49.52 110.194 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -83.79 -26.01 29.96 Favored 'General case' 0 C--O 1.265 1.877 0 CA-C-N 121.745 2.066 . . . . 45.88 112.679 -177.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.74 170.41 46.2 Favored Glycine 1 C--O 1.303 4.442 0 CA-C-N 119.912 1.233 . . . . 42.15 113.584 173.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.36 -29.96 68.06 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.32 1.848 . . . . 51.77 110.796 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -40.41 -58.13 1.62 Allowed 'General case' 0 C--O 1.194 -1.818 0 C-N-CA 124.625 1.17 . . . . 98.79 109.241 171.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.1 mmtm -100.73 24.87 8.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 127.885 2.474 . . . . 58.39 112.813 -170.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 56.4 27.51 12.16 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 122.489 1.138 . . . . 51.99 110.355 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 53.56 46.09 26.8 Favored 'General case' 1 C--O 1.315 4.55 0 O-C-N 118.144 -2.848 . . . . 40.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 59.0 mt -136.85 155.19 50.11 Favored 'General case' 0 C--O 1.186 -2.264 0 N-CA-C 108.373 -0.973 . . . . 28.46 108.373 166.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 41.4 tttt -77.34 121.08 83.94 Favored Pre-proline 0 N--CA 1.504 2.259 1 N-CA-C 99.532 -4.247 . . . . 39.5 99.532 -178.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -46.12 133.29 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.57 2.846 . . . . 43.91 110.923 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 55.99 23.7 6.98 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 127.692 2.397 . . . . 63.54 112.787 173.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -44.76 107.54 0.1 Allowed 'General case' 1 C--O 1.326 5.087 0 N-CA-C 103.541 -2.763 . . . . 47.03 103.541 173.219 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 91.6 p -72.37 -7.87 51.95 Favored 'General case' 0 C--O 1.261 1.673 0 O-C-N 126.238 2.211 . . . . 48.55 108.432 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -83.1 -14.52 53.52 Favored 'General case' 0 C--O 1.172 -2.999 0 CA-C-N 121.247 1.84 . . . . 47.14 109.645 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 83.8 t -80.18 113.64 19.88 Favored 'Isoleucine or valine' 0 C--O 1.16 -3.646 0 O-C-N 125.351 1.657 . . . . 32.33 109.155 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.9 mt -76.21 -43.37 37.36 Favored 'Isoleucine or valine' 0 C--O 1.179 -2.618 0 C-N-CA 115.467 -2.493 . . . . 45.22 106.6 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.53 159.93 41.23 Favored 'General case' 0 C--O 1.154 -3.963 0 N-CA-C 107.547 -1.279 . . . . 32.05 107.547 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 14.6 p80 -160.79 150.5 17.36 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.324 -0.991 . . . . 30.94 108.324 174.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.8 p -82.6 170.64 14.94 Favored 'General case' 1 C--O 1.144 -4.486 0 N-CA-C 114.714 1.376 . . . . 30.7 114.714 158.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -54.32 151.14 7.79 Favored 'General case' 0 C--O 1.157 -3.783 0 C-N-CA 129.56 3.144 . . . . 62.98 110.141 153.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 16.4 tp -79.82 128.27 33.23 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 128.328 3.518 . . . . 46.21 104.593 171.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 33.6 pt -131.31 148.86 32.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 O-C-N 124.106 0.879 . . . . 45.04 110.207 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.42 179.18 20.26 Favored Glycine 0 C--O 1.289 3.539 0 O-C-N 126.581 2.426 . . . . 54.61 111.976 165.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.1 t -31.04 132.59 0.09 Allowed 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 126.793 2.037 . . . . 63.63 110.789 -176.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.6 -12.37 6.08 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 116.275 -2.403 . . . . 64.27 112.923 171.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -87.89 169.35 12.11 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 122.46 3.13 . . . . 65.46 108.743 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -144.15 161.01 39.94 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 115.826 -2.035 . . . . 66.24 106.306 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -155.9 164.48 38.44 Favored 'General case' 0 C--O 1.184 -2.357 0 O-C-N 126.378 2.298 . . . . 42.77 107.147 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.9 t -139.31 145.6 39.3 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 127.51 2.324 . . . . 46.97 107.358 -166.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.9 p -141.9 140.53 30.12 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.83 0 O-C-N 126.03 2.081 . . . . 36.85 106.837 166.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.1 m -111.29 153.6 25.69 Favored 'General case' 1 C--O 1.308 4.133 0 CA-C-O 114.391 -2.718 . . . . 35.34 106.718 168.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -148.41 158.27 44.0 Favored 'General case' 0 CA--C 1.486 -1.483 0 O-C-N 125.938 2.024 . . . . 37.21 109.202 175.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.2 130.6 36.5 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 128.2 3.437 . . . . 80.94 109.064 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.8 t -72.25 -22.15 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 121.359 -0.838 . . . . 46.99 108.985 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.0 p -53.81 -26.66 25.15 Favored 'General case' 0 N--CA 1.513 2.723 0 CA-C-O 116.445 -1.74 . . . . 51.07 111.993 168.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -69.36 -19.61 63.84 Favored 'General case' 0 C--O 1.199 -1.584 0 CA-C-N 120.608 1.549 . . . . 63.1 110.244 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.2 mt -97.9 157.2 16.23 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.267 1.027 . . . . 65.48 112.174 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.9 mtpm? -134.91 144.76 47.67 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.446 1.498 . . . . 88.41 108.423 170.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 148.87 46.97 Favored 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 108.128 -1.064 . . . . 91.19 108.128 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 62.18 -1.32 1.45 Allowed Glycine 0 C--O 1.29 3.632 0 C-N-CA 127.573 2.511 . . . . 96.25 116.0 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -87.17 146.02 26.18 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 121.273 2.537 . . . . 97.53 106.564 171.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.8 124.66 39.92 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 108.121 -1.066 . . . . 57.13 108.121 -168.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -116.95 143.95 45.13 Favored 'General case' 0 C--O 1.197 -1.693 0 N-CA-C 105.892 -1.892 . . . . 47.54 105.892 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 90.8 mmm -118.9 151.76 37.53 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 116.731 -1.604 . . . . 62.21 107.606 171.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -114.5 150.74 34.39 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 115.825 -2.036 . . . . 38.41 108.686 162.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -167.18 161.38 14.49 Favored 'General case' 0 C--O 1.195 -1.766 0 CA-C-O 126.823 3.201 . . . . 33.63 109.511 -170.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . 0.252 10.8 t -96.55 138.85 33.5 Favored 'General case' 0 C--N 1.277 -2.56 0 CA-C-N 112.136 -2.302 . . . . 31.48 107.859 169.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 68.1 p -105.67 5.43 31.1 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.037 -1.465 . . . . 26.06 110.978 177.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -60.25 140.48 91.34 Favored Pre-proline 0 C--O 1.271 2.188 0 N-CA-C 104.204 -2.517 . . . . 36.87 104.204 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.41 114.47 1.57 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.43 3.42 . . . . 39.85 115.584 -173.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.5 5.1 75.79 Favored Glycine 1 C--O 1.152 -4.983 2 O-C-N 129.784 4.427 . . . . 43.62 106.924 167.439 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -75.76 -29.71 58.91 Favored 'General case' 1 C--O 1.309 4.198 0 CA-C-N 120.068 1.934 . . . . 41.12 109.976 -171.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.7 p -62.01 -23.41 66.42 Favored 'General case' 0 C--O 1.267 1.975 0 C-N-CA 127.688 2.395 . . . . 44.61 110.777 -171.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.23 -46.85 85.04 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 124.742 1.276 . . . . 63.25 107.724 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.68 11.94 Favored 'General case' 0 N--CA 1.498 1.975 0 CA-C-N 119.748 1.158 . . . . 69.92 112.093 177.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 71.4 mtp -94.84 80.26 3.71 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.985 -1.117 . . . . 44.8 107.985 -165.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.87 172.81 17.41 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 114.652 -2.594 . . . . 64.93 106.891 176.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 176.91 177.15 45.63 Favored Glycine 0 C--O 1.281 3.086 0 C-N-CA 127.602 2.525 . . . . 43.48 107.105 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 40.2 p -101.17 145.51 28.7 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 126.53 1.932 . . . . 50.85 107.113 -171.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 6.0 tt -127.6 123.26 35.26 Favored 'General case' 0 C--O 1.186 -2.244 0 N-CA-C 107.14 -1.43 . . . . 43.69 107.14 170.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.8 m -124.4 138.57 54.35 Favored 'General case' 0 C--O 1.286 3.007 0 O-C-N 123.734 0.646 . . . . 61.6 109.846 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' A' ' 127' ' ' LEU . 0.0 OUTLIER -87.18 104.04 15.99 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 114.556 -2.64 . . . . 66.62 108.521 166.864 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.518 2.955 0 C-N-CA 127.185 2.194 . . . . 90.14 110.61 -173.776 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.413 0 CA-C-O 117.458 -1.258 . . . . 84.19 108.097 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 81.5 m 60.28 27.49 17.04 Favored 'General case' 1 C--O 1.326 5.099 0 C-N-CA 125.1 1.36 . . . . 83.38 113.257 164.893 -60.221 -64.521 -94.691 102.557 2.071 106.087 -78.153 -65.99 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 62.1 p -140.72 168.78 18.98 Favored 'General case' 0 C--O 1.181 -2.53 0 O-C-N 123.511 0.507 . . . . 65.81 110.096 173.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.0 p -150.51 141.24 16.43 Favored 'Isoleucine or valine' 0 C--O 1.268 2.039 0 N-CA-C 105.884 -1.895 . . . . 52.79 105.884 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -101.51 119.4 38.71 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 127.093 2.745 . . . . 70.19 107.292 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 17.9 tt -127.68 143.02 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 119.043 0.838 . . . . 45.04 110.262 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -118.84 142.53 47.65 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 125.295 1.438 . . . . 56.51 107.659 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.29 124.35 5.89 Favored Glycine 0 C--O 1.282 3.151 0 N-CA-C 105.928 -2.869 . . . . 48.88 105.928 171.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -109.35 -174.13 2.43 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.19 1.995 . . . . 52.23 109.092 -172.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ASP . . . . . 0.463 ' HA ' ' HG2' ' B' ' 44' ' ' MET . 95.2 m-20 -67.59 -18.34 64.95 Favored 'General case' 0 C--O 1.274 2.351 0 C-N-CA 130.195 3.398 . . . . 73.47 113.249 174.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -86.4 10.73 14.2 Favored 'General case' 0 N--CA 1.514 2.727 0 N-CA-C 116.416 2.006 . . . . 84.29 116.416 165.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' MET . . . . . 0.483 ' HB2' ' HE1' ' B' ' 44' ' ' MET . 48.3 ttm 67.66 43.98 1.74 Allowed 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 105.029 -2.212 . . . . 70.47 105.029 172.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -124.17 153.19 41.92 Favored 'General case' 0 C--O 1.186 -2.258 0 CA-C-N 115.357 -0.838 . . . . 64.42 111.866 173.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -101.23 151.97 21.22 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 104.205 -2.517 . . . . 44.2 104.205 165.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 29.1 p-10 -87.86 7.31 31.3 Favored 'General case' 0 C--O 1.3 3.75 0 O-C-N 120.681 -1.262 . . . . 45.15 107.922 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 5.2 t -146.35 152.01 38.42 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 116.797 -1.573 . . . . 42.56 108.053 172.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -117.96 5.39 12.12 Favored 'General case' 0 C--O 1.16 -3.655 0 CA-C-O 115.385 -2.245 . . . . 47.89 112.012 173.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.07 113.88 1.05 Allowed 'General case' 1 C--O 1.308 4.183 0 CA-C-O 125.113 2.387 . . . . 46.73 111.354 -167.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 60.9 mt -114.3 131.79 65.27 Favored 'Isoleucine or valine' 0 C--O 1.25 1.093 0 CA-C-N 112.736 -2.029 . . . . 48.1 107.915 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 69.5 p -115.27 118.93 34.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 126.911 2.632 . . . . 58.34 106.723 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 92.3 t -102.3 108.44 23.96 Favored 'Isoleucine or valine' 0 C--O 1.288 3.11 0 O-C-N 126.26 2.225 . . . . 66.41 107.568 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -48.26 127.07 12.2 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 117.87 -1.062 . . . . 90.59 112.182 168.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -13.8 61.73 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 124.836 1.254 . . . . 106.7 110.706 -177.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.6 p -78.3 -23.54 47.09 Favored 'General case' 0 C--O 1.258 1.516 0 C-N-CA 126.158 1.783 . . . . 86.62 110.141 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.79 134.38 55.16 Favored 'General case' 0 C--O 1.287 3.042 0 CA-C-N 120.075 1.307 . . . . 86.17 108.49 176.161 -65.99 -78.153 -94.691 106.087 2.071 102.557 -64.521 -60.221 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -89.5 -31.03 17.85 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 115.956 -1.973 . . . . 93.77 107.351 168.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -123.67 144.39 49.67 Favored 'General case' 0 C--O 1.18 -2.579 0 CA-C-O 113.862 -2.97 . . . . 77.57 112.238 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . 0.255 61.7 t80 -126.66 131.47 51.42 Favored 'General case' 0 N--CA 1.507 2.409 0 CA-C-N 121.882 2.128 . . . . 54.74 106.973 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 40.5 m -113.83 131.98 56.05 Favored 'General case' 0 C--O 1.178 -2.683 0 CA-C-O 122.86 1.314 . . . . 54.17 108.402 -177.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -110.07 127.61 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 C-N-CA 124.869 1.268 . . . . 43.01 109.542 168.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -109.06 106.46 16.4 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 115.293 -2.289 . . . . 48.28 108.808 171.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -94.13 132.58 38.51 Favored 'General case' 0 C--O 1.283 2.826 0 O-C-N 128.689 3.743 . . . . 42.26 108.559 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 56.6 p -126.36 157.58 38.11 Favored 'General case' 0 CA--C 1.555 1.154 0 O-C-N 125.363 1.665 . . . . 45.23 109.643 167.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -113.66 96.9 42.35 Favored Pre-proline 0 C--O 1.254 1.33 0 O-C-N 127.15 2.781 . . . . 56.29 110.828 170.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PRO . . . . . 0.523 ' O ' ' O ' ' B' ' 37' ' ' GLY . 42.5 Cg_endo -70.6 -170.6 0.46 Allowed 'Trans proline' 0 C--N 1.377 2.046 0 CA-C-N 122.647 1.981 . . . . 58.65 112.016 161.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLY . . . . . 0.523 ' O ' ' O ' ' B' ' 36' ' ' PRO . . . 61.01 155.2 0.04 OUTLIER Glycine 0 N--CA 1.508 3.484 0 C-N-CA 115.507 -3.235 . . . . 61.53 112.341 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -101.92 3.31 38.97 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.457 2.303 . . . . 74.18 110.518 -144.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 16.3 mt -91.92 143.21 27.4 Favored Pre-proline 0 C--O 1.246 0.897 0 C-N-CA 117.026 -1.87 . . . . 65.84 106.754 -167.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -87.73 165.2 7.61 Favored 'Trans proline' 0 C--N 1.358 1.052 0 CA-C-N 114.207 -1.033 . . . . 67.69 114.105 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -58.01 -38.52 76.32 Favored 'General case' 0 CA--C 1.596 2.719 0 O-C-N 125.54 1.775 . . . . 56.24 110.559 -161.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.92 -12.12 60.56 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 121.266 1.848 . . . . 72.08 109.73 -176.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 2.3 t -107.76 -44.04 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 CA-C-N 119.172 0.896 . . . . 70.03 109.742 -176.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' MET . . . . . 0.483 ' HE1' ' HB2' ' B' ' 13' ' ' MET . 25.9 tpp -134.19 41.47 2.96 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.633 1.173 . . . . 60.31 110.038 -173.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.9 133.69 52.38 Favored Glycine 1 C--O 1.297 4.044 0 CA-C-O 118.593 -1.115 . . . . 50.79 114.038 175.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' HIS . . . . . 0.413 ' CE1' ' SD ' ' B' ' 121' ' ' MET . 26.0 m-70 -125.54 145.42 50.12 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 126.229 1.782 . . . . 40.67 108.673 172.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.7 p30 -139.35 176.36 8.78 Favored 'General case' 1 C--O 1.152 -4.059 0 O-C-N 128.372 3.545 . . . . 34.62 103.102 165.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -138.8 116.31 11.3 Favored 'General case' 0 CA--C 1.474 -1.949 0 N-CA-C 102.357 -3.201 . . . . 34.93 102.357 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' B' ' 110' ' ' PHE . 58.9 t -133.28 131.92 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 127.265 2.853 . . . . 37.94 103.597 -169.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.271 49.1 tp -109.55 129.44 55.57 Favored 'General case' 0 C--O 1.178 -2.682 0 C-N-CA 126.071 1.748 . . . . 44.41 109.451 174.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 87.4 p -144.32 175.33 10.18 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.88 2.072 . . . . 47.78 107.074 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 29.5 p -62.38 153.86 29.86 Favored 'General case' 1 C--O 1.315 4.505 0 N-CA-C 109.416 -0.587 . . . . 55.68 109.416 165.172 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.52 -37.84 68.45 Favored 'General case' 0 C--O 1.284 2.918 0 N-CA-C 115.86 1.8 . . . . 56.92 115.86 167.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.03 -38.63 89.42 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-O 122.538 1.161 . . . . 64.49 111.521 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -83.72 -13.26 54.42 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 113.525 -3.131 . . . . 73.45 113.7 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.4 ttt -55.56 -45.64 77.28 Favored 'General case' 0 C--N 1.366 1.294 0 CA-C-N 122.068 2.213 . . . . 53.2 111.8 -173.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLN . . . . . 0.572 ' OE1' HG23 ' B' ' 61' ' ' THR . 8.1 tp-100 -66.28 -42.88 87.78 Favored 'General case' 0 C--O 1.271 2.202 0 CA-C-N 122.36 2.345 . . . . 77.9 109.398 -170.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.04 -46.68 93.75 Favored Glycine 0 N--CA 1.505 3.29 0 CA-C-O 119.244 -0.753 . . . . 56.99 113.567 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 94.0 t -50.88 -53.04 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 CA-C-O 115.857 -2.02 . . . . 51.42 108.867 168.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.24 -48.19 81.98 Favored 'Isoleucine or valine' 0 C--O 1.273 2.309 0 CA-C-N 121.064 1.757 . . . . 48.95 108.701 -172.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' THR . . . . . 0.572 HG23 ' OE1' ' B' ' 57' ' ' GLN 0.307 33.6 p -70.83 -39.06 73.21 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 116.247 -1.835 . . . . 62.51 107.154 -172.931 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.03 -32.41 73.87 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 122.315 2.325 . . . . 74.79 109.232 174.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.02 49.77 Favored Glycine 0 C--O 1.196 -2.273 0 O-C-N 120.543 -1.348 . . . . 54.33 113.815 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' MET . . . . . 0.558 ' SD ' ' HE1' ' A' ' 64' ' ' MET . 66.3 ttp -61.8 -37.43 84.35 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 123.145 0.578 . . . . 93.75 110.091 -179.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -27.6 68.98 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 118.627 0.649 . . . . 66.78 109.931 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -24.02 30.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 116.292 -1.813 . . . . 62.99 112.781 -174.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.24 170.38 46.11 Favored Glycine 0 C--O 1.201 -1.935 0 O-C-N 124.371 1.044 . . . . 57.01 114.091 172.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 26.3 tp -58.49 -31.82 68.22 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 126.672 1.989 . . . . 60.79 110.891 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.55 -41.64 54.29 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-O 115.686 -2.102 . . . . 103.9 107.623 179.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm -109.03 32.46 4.91 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.128 2.571 . . . . 60.4 113.253 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 53.49 29.43 9.0 Favored 'General case' 0 N--CA 1.513 2.724 0 CA-C-N 120.637 1.562 . . . . 52.57 115.067 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 50.77 45.66 26.91 Favored 'General case' 0 C--O 1.267 2.0 0 C-N-CA 123.974 0.91 . . . . 48.45 112.997 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 18.4 mt -143.73 136.39 27.23 Favored 'General case' 0 C--O 1.156 -3.848 0 O-C-N 125.567 1.792 . . . . 53.03 108.847 176.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -78.91 130.37 70.35 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 101.713 -3.44 . . . . 59.92 101.713 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -55.38 128.28 29.77 Favored 'Trans proline' 0 C--O 1.283 2.755 0 C-N-CA 123.32 2.68 . . . . 64.98 112.442 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 55.9 27.56 11.24 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 126.043 2.09 . . . . 87.04 113.189 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -41.65 110.62 0.17 Allowed 'General case' 0 C--O 1.254 1.339 0 C-N-CA 126.344 1.858 . . . . 59.96 106.79 155.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 91.7 p -71.9 -6.84 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 124.366 1.041 . . . . 66.36 111.094 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -85.04 -14.38 47.51 Favored 'General case' 0 CA--C 1.557 1.246 0 O-C-N 120.213 -1.555 . . . . 61.7 107.578 -176.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' VAL . . . . . . . . . . . . . 87.7 t -84.67 111.83 20.93 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.897 0 CA-C-O 122.693 1.235 . . . . 58.41 109.283 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 97.1 mt -71.24 -41.3 74.85 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.498 0 C-N-CA 114.866 -2.734 . . . . 69.44 109.361 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -164.78 151.3 10.64 Favored 'General case' 0 C--O 1.261 1.702 0 CA-C-N 120.255 1.388 . . . . 55.4 107.369 -172.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -160.61 149.31 16.68 Favored 'General case' 0 C--O 1.263 1.796 0 CA-C-O 115.669 -2.11 . . . . 44.58 108.996 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.8 p -80.87 170.47 16.23 Favored 'General case' 0 C--O 1.182 -2.496 0 O-C-N 126.714 2.509 . . . . 42.08 112.289 160.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.4 mttp -58.54 155.46 12.23 Favored 'General case' 0 C--O 1.171 -3.051 0 C-N-CA 129.755 3.222 . . . . 72.4 106.885 163.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -81.55 133.31 35.37 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 125.739 1.899 . . . . 44.99 106.076 165.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 22.3 pt -134.81 146.4 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 105.877 -1.898 . . . . 47.86 105.877 -170.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . -109.13 -178.19 21.43 Favored Glycine 0 CA--C 1.537 1.423 0 O-C-N 125.803 1.94 . . . . 57.08 113.128 164.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 16.8 t -28.26 130.31 0.06 Allowed 'General case' 0 C--O 1.275 2.415 0 C-N-CA 127.125 2.17 . . . . 65.67 111.539 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.23 -21.7 23.21 Favored Glycine 0 C--N 1.351 1.365 0 CA-C-O 116.257 -2.413 . . . . 59.81 111.754 172.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -92.4 171.15 9.23 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-N 120.387 2.093 . . . . 64.14 112.442 -168.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.89 166.58 28.14 Favored 'General case' 0 C--O 1.153 -3.975 0 O-C-N 119.681 -1.887 . . . . 60.28 111.504 169.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -164.38 156.15 16.12 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.498 -1.667 . . . . 57.87 106.498 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . 0.279 0.3 OUTLIER -135.26 153.89 51.75 Favored 'General case' 0 C--O 1.184 -2.373 0 CA-C-N 111.949 -2.387 . . . . 53.47 107.53 -165.727 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.22 139.28 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 N-CA-C 107.251 -1.389 . . . . 47.22 107.251 173.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 90.9 m -118.51 141.84 48.17 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 127.565 3.041 . . . . 56.38 106.151 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -144.52 158.55 43.71 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 126.561 2.413 . . . . 59.67 106.454 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.1 124.93 28.63 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 126.14 2.15 . . . . 92.51 108.214 176.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.69 -25.86 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 125.265 1.426 . . . . 78.67 108.395 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 84.8 p -54.79 -27.1 39.04 Favored 'General case' 0 C--O 1.179 -2.647 0 C-N-CA 125.211 1.404 . . . . 88.89 111.43 171.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -70.1 -13.64 62.3 Favored 'General case' 0 C--O 1.194 -1.82 0 CA-C-O 115.352 -2.261 . . . . 92.71 110.7 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 54.5 mt -99.86 144.45 28.91 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-N 119.985 1.266 . . . . 86.31 110.078 177.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' B' ' 103' ' ' LYS . 30.5 mtpt -135.55 143.01 45.47 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 114.646 -2.597 . . . . 111.0 108.483 -173.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.53 146.58 51.4 Favored 'General case' 0 C--O 1.292 3.333 0 O-C-N 126.3 2.25 . . . . 116.96 108.305 -170.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 60.58 18.64 52.32 Favored Glycine 0 C--O 1.287 3.462 0 O-C-N 125.283 1.614 . . . . 92.24 114.802 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -97.43 147.7 23.95 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 106.041 -1.837 . . . . 87.27 106.041 156.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -96.06 126.11 41.06 Favored 'General case' 1 C--O 1.323 4.96 0 CA-C-O 115.858 -2.02 . . . . 69.16 106.938 -175.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -110.72 140.83 44.76 Favored 'General case' 0 C--O 1.175 -2.817 0 O-C-N 126.631 2.457 . . . . 69.31 110.752 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' MET . . . . . . . . . . . . . 92.7 mmm -122.05 139.19 54.01 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 105.887 -1.894 . . . . 56.64 105.887 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' B' ' 49' ' ' VAL 0.256 12.8 p90 -101.7 149.02 24.57 Favored 'General case' 0 C--O 1.167 -3.247 0 O-C-N 124.328 1.017 . . . . 39.92 109.317 162.861 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -163.88 159.6 21.21 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 108.108 -1.071 . . . . 38.44 108.108 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' CYS . . . . . . . . . . . . . 37.0 t -94.81 136.36 35.21 Favored 'General case' 0 C--O 1.187 -2.205 0 CA-C-O 115.977 -1.963 . . . . 40.17 108.266 167.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 77.6 p -103.72 9.96 36.92 Favored 'General case' 0 C--O 1.184 -2.388 0 C-N-CA 127.996 2.518 . . . . 39.46 110.361 -175.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -64.51 142.69 98.48 Favored Pre-proline 0 C--N 1.306 -1.305 0 N-CA-C 104.279 -2.489 . . . . 43.46 104.279 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' PRO . . . . . 0.547 ' HB3' ' HE1' ' A' ' 64' ' ' MET . 11.0 Cg_exo -56.64 109.04 0.39 Allowed 'Trans proline' 0 C--O 1.19 -1.911 0 C-N-CA 122.608 2.205 . . . . 46.88 114.862 -176.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.59 7.32 56.88 Favored Glycine 1 C--O 1.306 4.6 2 C-N-CA 135.806 6.431 . . . . 48.35 110.594 168.007 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -82.23 -18.45 42.49 Favored 'General case' 1 C--O 1.141 -4.652 0 C-N-CA 115.309 -2.557 . . . . 53.09 110.572 -171.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.7 p -73.28 -21.81 60.52 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 118.623 -2.548 . . . . 68.77 108.759 -168.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -51.96 -59.81 3.91 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 121.302 1.864 . . . . 62.23 109.861 169.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 1.5 mt -87.45 -32.79 19.31 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 117.282 -1.342 . . . . 60.27 111.294 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' MET . . . . . 0.413 ' SD ' ' CE1' ' B' ' 46' ' ' HIS . 96.0 mtp -100.24 80.5 2.27 Favored 'General case' 1 C--O 1.091 -7.263 0 N-CA-C 105.419 -2.067 . . . . 47.09 105.419 -161.019 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.91 159.88 37.02 Favored 'General case' 0 CA--C 1.497 -1.058 0 N-CA-C 106.908 -1.515 . . . . 67.13 106.908 -178.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.51 -170.58 34.19 Favored Glycine 0 C--O 1.214 -1.097 0 O-C-N 126.793 2.558 . . . . 44.66 108.128 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 41.0 p -99.56 143.47 29.76 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 126.547 1.939 . . . . 51.12 107.289 -174.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 4.5 tt -124.29 120.42 32.14 Favored 'General case' 0 CA--C 1.488 -1.415 0 O-C-N 124.724 1.265 . . . . 51.35 108.349 166.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -123.98 144.02 50.06 Favored 'General case' 1 C--O 1.309 4.215 0 O-C-N 127.359 2.912 . . . . 63.41 111.413 -173.021 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -81.53 97.57 7.88 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 109.428 -3.533 . . . . 89.54 111.524 171.656 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.301 3.793 1 CA-C-O 134.253 6.739 . . . . 96.58 106.979 -173.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.548 4.474 0 N-CA-C 109.654 -0.499 . . . . 64.45 109.654 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 m 55.12 19.5 2.85 Favored 'General case' 0 N--CA 1.513 2.7 0 N-CA-C 115.576 1.695 . . . . 73.67 115.576 175.78 -53.007 -56.867 -86.667 106.482 2.111 103.885 -83.395 -60.53 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' SER . . . . . . . . . . . . . 80.5 p -136.11 170.86 15.33 Favored 'General case' 0 C--O 1.195 -1.777 0 CA-C-N 120.466 1.485 . . . . 55.55 110.397 168.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' VAL . . . . . . . . . . . . . 14.4 p -150.65 140.93 16.14 Favored 'Isoleucine or valine' 0 C--O 1.272 2.277 0 N-CA-C 104.368 -2.456 . . . . 61.9 104.368 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -104.14 119.37 38.8 Favored 'General case' 0 C--O 1.256 1.395 0 O-C-N 126.387 2.305 . . . . 89.51 106.124 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ILE . . . . . 0.435 HD11 HD11 ' C' ' 20' ' ' ILE . 50.2 mt -129.48 144.19 38.84 Favored 'Isoleucine or valine' 0 C--O 1.164 -3.398 0 CA-C-N 119.38 0.991 . . . . 73.38 109.047 -175.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -123.63 136.16 54.34 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 102.369 -3.197 . . . . 75.57 102.369 -173.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.33 130.6 9.68 Favored Glycine 0 C--O 1.26 1.744 0 O-C-N 128.437 3.586 . . . . 71.14 107.703 159.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ASN . . . . . . . . . . . . . 52.2 p30 -110.33 -171.89 1.92 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 119.126 1.463 . . . . 72.73 110.022 -174.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -68.73 -10.74 58.25 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 126.418 2.324 . . . . 105.84 113.638 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -103.95 16.7 25.71 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 122.225 2.284 . . . . 92.28 110.705 173.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' MET . . . . . . . . . . . . . 3.2 ttm 65.34 41.09 4.48 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.957 -1.127 . . . . 83.3 107.957 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -119.37 129.71 54.96 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 125.014 1.326 . . . . 75.16 109.472 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -83.86 146.86 27.86 Favored 'General case' 0 C--O 1.166 -3.311 0 N-CA-C 107.197 -1.409 . . . . 60.46 107.197 162.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -78.44 11.57 2.39 Favored 'General case' 0 C--O 1.176 -2.8 0 CA-C-N 120.818 1.645 . . . . 72.53 108.212 -178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' THR . . . . . . . . . . . . . 3.7 t -156.62 154.61 30.45 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 106.851 -1.537 . . . . 65.22 106.851 172.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 53.6 p30 -131.95 17.75 4.63 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 125.593 1.808 . . . . 85.39 108.491 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -160.73 130.33 4.97 Favored 'General case' 0 C--O 1.159 -3.693 0 CA-C-O 117.093 -1.432 . . . . 58.61 111.9 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ILE . . . . . 0.435 HD11 HD11 ' C' ' 7' ' ' ILE . 79.5 mt -125.35 140.36 48.52 Favored 'Isoleucine or valine' 0 C--O 1.281 2.737 0 C-N-CA 126.825 2.05 . . . . 48.48 106.733 -176.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' THR . . . . . . . . . . . . . 81.6 p -124.81 129.38 50.32 Favored 'General case' 0 C--O 1.279 2.607 0 N-CA-C 103.282 -2.858 . . . . 67.91 103.282 179.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 62.7 t -109.09 109.33 27.97 Favored 'Isoleucine or valine' 0 C--O 1.273 2.31 0 O-C-N 126.719 2.512 . . . . 54.31 104.341 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -50.38 127.42 17.37 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 126.506 2.379 . . . . 97.75 110.018 168.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -74.14 -7.82 53.96 Favored 'General case' 0 C--O 1.275 2.409 0 CA-C-O 117.128 -1.415 . . . . 88.86 109.595 -175.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 82.7 p -74.11 -25.88 60.03 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 117.549 -1.215 . . . . 59.42 111.384 167.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' CYS . . . . . . . . . . . . . 79.4 m -63.96 132.76 51.64 Favored 'General case' 0 C--O 1.298 3.613 0 CA-C-N 119.927 1.24 . . . . 64.08 110.621 177.661 -60.53 -83.395 -86.667 103.885 2.111 106.482 -56.867 -53.007 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -90.78 -31.61 16.44 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 116.601 -1.666 . . . . 58.37 108.388 170.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -131.53 149.97 52.32 Favored 'General case' 1 C--O 1.316 4.558 0 CA-C-N 120.469 1.486 . . . . 55.6 110.631 174.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 29' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -126.0 140.35 52.68 Favored 'General case' 0 C--O 1.271 2.228 0 N-CA-C 106.219 -1.771 . . . . 47.15 106.219 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 29.7 m -119.51 135.57 54.71 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.876 1.36 . . . . 52.14 111.311 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' VAL . . . . . . . . . . . . . 28.3 t -116.28 127.11 73.98 Favored 'Isoleucine or valine' 0 C--O 1.305 3.986 0 CA-C-O 117.59 -1.195 . . . . 50.43 108.099 172.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -112.82 112.14 23.42 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 126.957 2.661 . . . . 68.87 107.505 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 24.7 tp -101.1 139.44 36.78 Favored 'General case' 1 C--O 1.346 6.143 0 O-C-N 127.125 2.765 . . . . 59.13 106.863 -178.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 34' ' ' SER . . . . . . . . . . . . . 4.2 p -135.4 156.5 48.83 Favored 'General case' 0 N--CA 1.503 2.189 0 CA-C-O 117.223 -1.37 . . . . 63.88 107.906 175.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -118.31 94.93 47.89 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 126.622 2.451 . . . . 80.17 109.194 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' PRO . . . . . 0.562 ' O ' ' O ' ' C' ' 37' ' ' GLY . 54.6 Cg_endo -69.06 -174.44 0.77 Allowed 'Trans proline' 0 C--N 1.368 1.565 0 CA-C-N 121.938 1.728 . . . . 94.7 112.693 160.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 37' ' ' GLY . . . . . 0.562 ' O ' ' O ' ' C' ' 36' ' ' PRO . . . 57.36 157.34 0.01 OUTLIER Glycine 0 C--O 1.271 2.421 0 O-C-N 119.522 -1.986 . . . . 99.79 111.602 -179.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 m-20 -99.54 9.35 43.36 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 126.077 1.751 . . . . 114.56 111.891 -148.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 mt -91.02 141.84 26.86 Favored Pre-proline 0 N--CA 1.475 0.786 0 C-N-CA 118.441 -1.304 . . . . 91.64 107.88 -170.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -80.68 161.18 21.8 Favored 'Trans proline' 0 C--O 1.201 -1.34 0 N-CA-C 116.405 1.656 . . . . 88.78 116.405 174.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -53.41 -41.37 65.94 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 128.214 2.606 . . . . 78.0 110.626 -167.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -71.81 -12.37 61.26 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 120.264 1.393 . . . . 85.45 110.306 -174.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.37 -46.12 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 C-N-CA 124.638 1.175 . . . . 94.66 109.288 -171.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' MET . . . . . . . . . . . . . 30.2 tpp -133.42 39.81 3.2 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 125.577 1.551 . . . . 96.68 108.911 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.71 139.56 46.93 Favored Glycine 0 C--O 1.285 3.343 0 O-C-N 123.174 0.296 . . . . 69.77 112.914 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -129.66 141.56 50.9 Favored 'General case' 0 C--O 1.271 2.209 0 N-CA-C 107.956 -1.127 . . . . 56.33 107.956 171.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASN . . . . . . . . . . . . . 56.4 p30 -134.1 170.36 15.78 Favored 'General case' 0 C--O 1.261 1.695 0 C-N-CA 126.996 2.118 . . . . 45.31 107.563 164.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -127.08 118.9 25.32 Favored 'General case' 0 C--O 1.177 -2.726 0 CA-C-O 115.576 -2.154 . . . . 40.9 106.076 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 48.4 t -131.03 124.02 55.08 Favored 'Isoleucine or valine' 1 C--O 1.137 -4.818 0 O-C-N 126.28 2.238 . . . . 39.74 106.855 -175.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 31.1 tp -99.97 128.67 46.03 Favored 'General case' 0 C--N 1.282 -2.361 0 C-N-CA 127.215 2.206 . . . . 32.02 108.23 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' SER . . . . . . . . . . . . . 59.3 p -136.62 176.33 8.8 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 125.909 1.684 . . . . 34.56 108.024 162.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' THR . . . . . . . . . . . . . 30.8 p -56.97 150.7 16.25 Favored 'General case' 0 C--N 1.276 -2.602 0 C-N-CA 125.038 1.335 . . . . 39.36 108.439 158.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.52 -42.36 78.28 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-O 117.301 -1.333 . . . . 42.14 110.22 167.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.67 -41.31 81.3 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 119.595 1.088 . . . . 54.0 111.935 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -82.5 -12.99 57.41 Favored 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 117.334 2.346 . . . . 53.83 117.334 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' MET . . . . . . . . . . . . . 21.4 ttt -53.5 -52.88 58.16 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-O 116.434 -1.746 . . . . 59.51 112.589 -173.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -61.49 -36.16 79.69 Favored 'General case' 0 N--CA 1.508 2.461 0 CA-C-N 122.76 2.527 . . . . 85.3 108.78 -169.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.79 -45.98 79.02 Favored Glycine 0 C--O 1.278 2.887 0 CA-C-N 120.74 1.609 . . . . 48.77 112.095 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' VAL . . . . . . . . . . . . . 53.6 t -58.26 -48.14 85.64 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.596 0 N-CA-C 106.127 -1.805 . . . . 47.4 106.127 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.6 -48.19 85.88 Favored 'Isoleucine or valine' 0 C--O 1.29 3.201 0 CA-C-N 121.881 2.128 . . . . 52.67 110.01 -171.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' THR . . . . . . . . . . . . 0.3 40.0 p -70.32 -40.49 74.14 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 114.392 -2.718 . . . . 72.55 108.134 -174.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -64.67 -39.23 93.32 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 107.156 -1.424 . . . . 67.86 107.156 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.93 -43.75 81.5 Favored Glycine 0 N--CA 1.481 1.634 0 C-N-CA 118.669 -1.729 . . . . 56.48 112.117 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' MET . . . . . . . . . . . . . 38.5 ttp -58.44 -41.16 84.47 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.683 1.242 . . . . 101.0 108.975 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.29 -27.87 67.64 Favored 'General case' 0 C--O 1.196 -1.734 0 O-C-N 124.513 1.133 . . . . 70.97 111.061 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.25 -25.23 27.4 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 121.215 1.825 . . . . 67.48 112.554 -173.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.32 172.14 47.76 Favored Glycine 0 N--CA 1.476 1.313 0 CA-C-O 117.803 -1.554 . . . . 62.74 113.84 164.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' LEU . . . . . . . . . . . . . 30.0 tp -59.44 -35.29 73.76 Favored 'General case' 0 C--O 1.292 3.302 0 C-N-CA 126.628 1.971 . . . . 71.03 110.97 -167.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -50.43 -47.8 56.56 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 127.621 3.075 . . . . 101.89 109.498 178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -96.24 17.77 15.11 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 126.801 2.04 . . . . 75.64 110.405 -167.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 60.32 23.55 13.01 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-O 117.293 -1.337 . . . . 75.1 109.386 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 61.41 43.27 10.64 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.904 1.377 . . . . 56.94 109.006 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 mt -133.88 142.58 47.84 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-O 116.776 -1.583 . . . . 53.66 109.515 167.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -57.1 123.88 62.57 Favored Pre-proline 0 C--O 1.206 -1.195 0 O-C-N 127.187 2.804 . . . . 85.29 106.861 165.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -46.28 132.97 15.55 Favored 'Trans proline' 0 C--O 1.273 2.244 0 C-N-CA 124.503 3.469 . . . . 76.04 112.966 163.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 52.26 26.32 3.93 Favored 'General case' 0 C--O 1.27 2.137 0 C-N-CA 125.397 1.479 . . . . 92.29 114.636 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -49.29 110.42 0.37 Allowed 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.225 -1.769 . . . . 62.68 106.225 171.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 84.7 p -67.77 -14.82 63.27 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 124.833 1.333 . . . . 62.41 110.822 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -79.34 -16.62 56.02 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 123.802 0.689 . . . . 62.98 109.911 -178.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' VAL . . . . . . . . . . . . . 94.9 t -80.78 112.88 19.38 Favored 'Isoleucine or valine' 0 C--O 1.175 -2.833 0 CA-C-O 122.095 0.95 . . . . 39.19 109.665 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 87.7 mt -73.23 -42.69 58.0 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.217 0 O-C-N 119.76 -1.837 . . . . 44.8 106.671 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.75 158.35 25.65 Favored 'General case' 0 C--O 1.265 1.897 0 N-CA-C 105.319 -2.104 . . . . 32.27 105.319 -174.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -159.67 152.53 21.67 Favored 'General case' 0 C--O 1.161 -3.572 0 O-C-N 118.688 -2.508 . . . . 42.07 110.909 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' THR . . . . . . . . . . . . . 16.0 p -84.34 166.65 17.24 Favored 'General case' 0 C--O 1.187 -2.208 0 O-C-N 123.975 0.797 . . . . 42.89 110.58 161.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' LYS . . . . . . . . . . . . . 28.4 mttp -56.69 156.96 5.78 Favored 'General case' 0 C--N 1.287 -2.128 0 C-N-CA 131.105 3.762 . . . . 82.23 109.706 156.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 24.2 tp -81.88 133.16 35.3 Favored 'General case' 0 C--O 1.171 -3.062 0 CA-C-O 114.283 -2.77 . . . . 67.94 109.38 172.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' ILE . . . . . . . . . . . . . 5.8 pt -133.32 145.28 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 125.166 1.541 . . . . 65.98 110.786 -170.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.96 178.86 18.97 Favored Glycine 0 N--CA 1.475 1.252 0 O-C-N 124.535 1.147 . . . . 76.59 113.335 168.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -34.54 129.92 0.39 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 127.51 2.324 . . . . 93.24 110.659 -172.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.22 -2.08 46.22 Favored Glycine 0 C--O 1.18 -3.265 0 CA-C-O 116.638 -2.201 . . . . 84.82 114.03 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -84.93 171.97 11.74 Favored 'General case' 0 C--O 1.268 2.078 0 CA-C-N 121.233 2.516 . . . . 82.27 110.42 173.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -150.93 154.61 37.48 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 107.363 -1.347 . . . . 87.76 107.363 170.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -153.95 158.42 40.64 Favored 'General case' 0 C--O 1.2 -1.541 0 O-C-N 125.181 1.55 . . . . 66.04 107.611 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' SER . . . . . . . . . . . . . 1.9 t -140.21 146.17 38.36 Favored 'General case' 0 C--O 1.283 2.862 0 C-N-CA 125.638 1.575 . . . . 58.62 107.262 -163.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.21 144.07 21.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 106.225 -1.769 . . . . 45.77 106.225 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' THR . . . . . . . . . . . . . 98.1 m -125.4 142.57 51.43 Favored 'General case' 0 CA--C 1.486 -1.501 0 N-CA-C 103.763 -2.681 . . . . 48.11 103.763 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -143.87 159.71 42.07 Favored 'General case' 0 C--O 1.278 2.575 0 O-C-N 126.23 2.206 . . . . 40.2 106.598 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -79.11 125.52 29.52 Favored 'General case' 1 C--O 1.333 5.454 0 O-C-N 126.331 2.269 . . . . 68.88 108.517 174.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . . 43.3 t -52.65 -27.93 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 C-N-CA 124.679 1.191 . . . . 44.97 112.753 166.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 100' ' ' SER . . . . . . . . . . . . . 82.0 p -59.18 -22.4 60.92 Favored 'General case' 0 C--O 1.176 -2.812 0 CA-C-N 120.347 1.43 . . . . 45.61 112.743 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -71.34 -15.32 62.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 121.907 2.14 . . . . 64.78 111.673 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -98.38 156.37 16.77 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 125.392 1.477 . . . . 48.71 110.517 177.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -129.48 147.81 51.33 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-O 117.76 -1.114 . . . . 110.18 108.66 171.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.33 138.14 21.79 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 125.563 1.545 . . . . 92.82 107.955 169.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 55.25 27.8 47.85 Favored Glycine 1 C--O 1.317 5.31 0 C-N-CA 126.706 2.098 . . . . 62.42 115.619 177.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 106' ' ' GLU . . . . . . . . . . . . 0.268 20.1 tp10 -100.24 149.47 23.54 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 106.375 -1.713 . . . . 72.97 106.375 162.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 107' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -97.13 127.91 43.54 Favored 'General case' 0 C--O 1.291 3.259 0 O-C-N 119.896 -1.752 . . . . 49.06 110.697 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 108' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.95 147.77 45.01 Favored 'General case' 0 C--O 1.284 2.895 0 N-CA-C 105.958 -1.867 . . . . 37.57 105.958 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' MET . . . . . . . . . . . . . 68.4 mmm -127.31 147.13 50.25 Favored 'General case' 0 C--O 1.278 2.571 0 N-CA-C 104.535 -2.395 . . . . 61.95 104.535 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.13 149.42 35.66 Favored 'General case' 0 C--O 1.182 -2.451 0 N-CA-C 103.803 -2.666 . . . . 45.24 103.803 169.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 111' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -162.83 157.02 20.86 Favored 'General case' 0 C--O 1.3 3.742 0 CA-C-O 127.909 3.718 . . . . 38.64 107.195 -175.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' CYS . . . . . . . . . . . . . 43.5 t -84.12 134.97 34.57 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 112.26 -2.246 . . . . 53.66 108.509 162.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' THR . . . . . . . . . . . . . 57.6 p -104.13 9.89 36.09 Favored 'General case' 0 C--O 1.289 3.183 0 CA-C-N 120.255 1.389 . . . . 43.3 109.53 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 114' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -56.01 136.15 73.63 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 106.742 -1.577 . . . . 50.39 106.742 168.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -55.46 116.64 3.29 Favored 'Trans proline' 0 C--O 1.294 3.29 0 C-N-CA 123.383 2.722 . . . . 55.38 115.109 -170.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' GLY . . . . . . . . . . . . . . . 81.82 6.53 88.93 Favored Glycine 0 C--N 1.356 1.69 1 O-C-N 129.863 4.477 . . . . 65.84 110.548 173.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 117' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -78.1 -24.61 47.48 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.692 1.246 . . . . 63.44 108.164 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' SER . . . . . . . . . . . . . 14.2 p -68.77 -18.97 64.3 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-O 117.824 -1.084 . . . . 63.95 109.911 -170.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.9 -48.03 72.84 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 105.831 -1.914 . . . . 69.86 105.831 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' LEU . . . . . 0.449 ' N ' HD23 ' C' ' 120' ' ' LEU . 2.8 mt -85.42 -45.38 11.91 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 116.43 -1.748 . . . . 95.86 111.07 177.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' MET . . . . . . . . . . . . . 55.1 mtp -97.53 82.88 3.15 Favored 'General case' 0 C--O 1.284 2.914 0 N-CA-C 105.963 -1.865 . . . . 70.47 105.963 -159.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.01 171.54 16.68 Favored 'General case' 0 C--O 1.201 -1.477 0 N-CA-C 106.087 -1.82 . . . . 72.81 106.087 174.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.34 -172.57 40.34 Favored Glycine 0 C--N 1.289 -2.064 0 N-CA-C 108.99 -1.644 . . . . 46.9 108.99 168.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' THR . . . . . . . . . . . . . 23.9 p -101.09 150.48 22.87 Favored 'General case' 0 C--O 1.282 2.79 0 C-N-CA 125.533 1.533 . . . . 44.8 107.843 -172.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 tt -133.98 125.1 27.46 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 104.168 -2.53 . . . . 47.88 104.168 171.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 126' ' ' THR . . . . . . . . . . . . . 6.4 m -124.02 136.76 54.49 Favored 'General case' 1 C--O 1.312 4.371 0 CA-C-O 117.346 -1.311 . . . . 54.39 110.961 -178.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 127' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' C' ' 127' ' ' LEU . 0.0 OUTLIER -82.98 104.05 12.89 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 114.238 -2.791 . . . . 54.7 109.175 165.561 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.899 0 O-C-N 127.155 2.785 . . . . 92.56 111.039 -172.862 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 N-CA-C 107.297 -1.371 . . . . 110.22 107.297 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' CYS . . . . . . . . . . . . . 60.4 m 63.31 30.56 15.63 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 124.91 1.284 . . . . 106.13 113.983 160.272 -55.717 -69.604 -88.108 103.311 2.054 104.163 -78.661 -62.31 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' SER . . . . . . . . . . . . . 19.3 p -138.25 169.3 18.03 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 119.142 0.883 . . . . 84.79 111.732 168.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.23 144.55 18.13 Favored 'Isoleucine or valine' 1 C--O 1.327 5.145 0 N-CA-C 107.408 -1.33 . . . . 65.13 107.408 167.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -100.82 122.07 42.78 Favored 'General case' 0 C--O 1.193 -1.898 0 N-CA-C 107.344 -1.354 . . . . 79.91 107.344 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ILE . . . . . 0.539 HD11 HD11 ' D' ' 20' ' ' ILE . 55.2 mt -122.87 156.56 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.597 0 CA-C-O 122.683 1.23 . . . . 66.18 108.796 175.35 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 8' ' ' GLN . . . . . 0.47 ' OE1' ' HG3' ' D' ' 36' ' ' PRO 0.286 43.8 mt-30 -129.54 146.39 51.37 Favored 'General case' 1 C--O 1.345 6.089 0 C-N-CA 129.79 3.236 . . . . 74.16 109.121 175.577 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 131.45 7.77 Favored Glycine 0 C--O 1.267 2.218 0 CA-C-N 110.308 -3.133 . . . . 56.9 108.379 170.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -112.39 -172.46 2.05 Favored 'General case' 0 C--O 1.288 3.104 0 O-C-N 124.696 0.88 . . . . 62.28 108.819 -173.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ASP . . . . . 0.466 ' HA ' ' HG2' ' D' ' 44' ' ' MET . 91.0 m-20 -70.77 -12.51 61.6 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 129.075 2.95 . . . . 80.89 111.728 176.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -103.34 16.74 25.75 Favored 'General case' 0 C--O 1.277 2.52 0 CA-C-O 116.268 -1.825 . . . . 77.87 110.411 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' MET . . . . . . . . . . . . . 36.0 ttm 58.71 42.75 19.75 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-N 119.837 1.198 . . . . 60.84 111.231 175.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -120.43 133.71 55.38 Favored 'General case' 1 C--O 1.305 4.009 0 C-N-CA 126.496 1.918 . . . . 70.47 109.304 175.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -83.46 161.56 21.25 Favored 'General case' 0 C--O 1.172 -3.026 0 CA-C-O 117.083 -1.437 . . . . 53.87 107.773 158.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -89.88 10.21 24.66 Favored 'General case' 0 N--CA 1.524 3.231 0 N-CA-C 106.165 -1.791 . . . . 61.23 106.165 -174.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' THR . . . . . . . . . . . . . 1.7 t -165.12 156.77 15.0 Favored 'General case' 1 C--O 1.382 8.064 0 N-CA-C 104.62 -2.363 . . . . 58.31 104.62 -175.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -133.29 15.16 4.14 Favored 'General case' 0 C--O 1.255 1.369 0 C-N-CA 126.115 1.766 . . . . 88.5 108.934 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -154.65 131.66 10.92 Favored 'General case' 0 C--O 1.183 -2.42 0 CA-C-O 115.192 -2.337 . . . . 59.89 112.764 174.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ILE . . . . . 0.539 HD11 HD11 ' D' ' 7' ' ' ILE . 60.0 mt -125.67 131.71 71.7 Favored 'Isoleucine or valine' 0 C--O 1.303 3.91 0 C-N-CA 126.046 1.739 . . . . 57.84 107.688 -178.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 21' ' ' THR . . . . . . . . . . . . . 70.4 p -117.01 129.43 56.02 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 125.78 1.925 . . . . 73.68 106.57 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' VAL . . . . . . . . . . . . . 93.1 t -118.92 106.74 20.03 Favored 'Isoleucine or valine' 0 C--O 1.304 3.957 0 N-CA-C 103.492 -2.781 . . . . 59.15 103.492 -173.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.92 126.62 18.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 127.427 2.955 . . . . 98.56 110.814 169.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -15.48 59.74 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.443 1.897 . . . . 105.95 110.349 -178.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 25' ' ' SER . . . . . . . . . . . . . 85.4 p -80.37 -22.34 41.44 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.842 1.657 . . . . 102.97 109.868 177.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' CYS . . . . . 0.456 ' O ' ' O ' ' D' ' 301' ' ' HOH . 71.4 m -62.76 132.82 53.5 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-N 119.996 1.271 . . . . 99.86 108.437 172.458 -62.31 -78.661 -88.108 104.163 2.054 103.311 -69.604 -55.717 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -31.35 18.75 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 117.022 -1.466 . . . . 100.74 108.778 173.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 -128.69 146.17 50.96 Favored 'General case' 0 C--O 1.256 1.406 0 C-N-CA 124.426 1.09 . . . . 57.79 110.874 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' PHE . . . . . 0.485 ' O ' ' HA ' ' D' ' 96' ' ' THR . 81.0 t80 -123.81 142.63 50.93 Favored 'General case' 0 C--O 1.263 1.764 0 CA-C-N 121.919 2.145 . . . . 57.98 107.711 178.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 13.8 m -117.87 134.36 55.01 Favored 'General case' 1 C--O 1.131 -5.173 0 N-CA-C 115.374 1.62 . . . . 58.88 115.374 -179.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -117.49 131.35 70.47 Favored 'Isoleucine or valine' 0 C--O 1.273 2.298 0 N-CA-C 106.855 -1.535 . . . . 55.23 106.855 173.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -113.15 110.53 20.58 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 105.219 -2.141 . . . . 57.71 105.219 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' LEU . . . . . . . . . . . . . 11.6 tp -104.82 143.53 33.01 Favored 'General case' 1 C--O 1.309 4.189 0 O-C-N 120.313 -1.492 . . . . 61.47 108.67 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 34' ' ' SER . . . . . . . . . . . . . 53.4 p -147.74 157.52 43.58 Favored 'General case' 0 C--O 1.266 1.966 0 C-N-CA 125.295 1.438 . . . . 73.95 109.355 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -116.34 96.14 47.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 128.151 2.581 . . . . 74.18 111.277 -177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' PRO . . . . . 0.585 ' O ' ' O ' ' D' ' 37' ' ' GLY . 18.8 Cg_endo -63.45 -170.93 0.12 Allowed 'Trans proline' 0 C--O 1.182 -2.293 0 C-N-CA 122.577 2.184 . . . . 94.41 114.369 155.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 37' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' D' ' 36' ' ' PRO . . . 56.15 160.23 0.01 OUTLIER Glycine 0 C--O 1.282 3.104 0 O-C-N 118.733 -2.48 . . . . 104.01 111.37 178.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -99.36 6.72 46.02 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 127.419 2.287 . . . . 101.87 110.901 -153.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 23.7 mt -94.64 141.51 23.5 Favored Pre-proline 0 C--O 1.213 -0.853 0 C-N-CA 117.015 -1.874 . . . . 99.25 107.91 -166.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -79.4 163.88 24.33 Favored 'Trans proline' 0 C--O 1.199 -1.469 0 C-N-CA 122.796 2.331 . . . . 97.85 117.367 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -53.87 -41.6 67.7 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 127.106 2.163 . . . . 91.73 111.689 -167.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' ASN . . . . . 0.498 ' HA ' HD13 ' D' ' 68' ' ' LEU . 17.0 p-10 -75.71 -12.59 60.22 Favored 'General case' 0 C--O 1.297 3.554 0 CA-C-N 121.668 2.031 . . . . 80.16 108.843 -172.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -108.2 -44.82 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 114.75 -2.548 . . . . 71.68 108.127 -173.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' D' ' 11' ' ' ASP . 28.5 tpp -134.35 41.13 2.96 Favored 'General case' 0 C--O 1.28 2.665 0 O-C-N 126.034 2.084 . . . . 71.39 109.987 -175.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.45 136.77 46.35 Favored Glycine 0 C--O 1.264 2.031 0 CA-C-N 117.819 0.281 . . . . 56.46 113.702 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -127.61 149.04 50.36 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 118.293 -0.861 . . . . 48.83 109.802 172.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -138.27 177.37 7.93 Favored 'General case' 0 C--O 1.277 2.54 0 N-CA-C 105.679 -1.971 . . . . 35.11 105.679 160.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 48' ' ' TRP . . . . . . . . . . . . 0.278 67.6 t90 -126.75 120.3 29.03 Favored 'General case' 0 C--O 1.175 -2.828 0 N-CA-C 103.346 -2.835 . . . . 31.13 103.346 174.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 49' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' D' ' 110' ' ' PHE . 52.0 t -132.86 129.42 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 N-CA-C 104.888 -2.264 . . . . 24.57 104.888 -173.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 50' ' ' LEU . . . . . . . . . . . . . 25.0 tp -100.29 131.72 46.07 Favored 'General case' 0 C--N 1.281 -2.371 0 C-N-CA 129.45 3.1 . . . . 25.9 108.578 170.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 51' ' ' SER . . . . . . . . . . . . . 60.5 p -145.61 174.75 10.91 Favored 'General case' 0 C--N 1.312 -1.034 0 O-C-N 125.973 2.045 . . . . 38.76 108.334 159.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' THR . . . . . . . . . . . . . 63.9 p -56.6 153.77 9.8 Favored 'General case' 1 C--O 1.314 4.453 0 C-N-CA 119.786 -0.766 . . . . 53.33 109.397 163.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.1 -38.92 54.63 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 117.807 -1.092 . . . . 61.52 112.501 163.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -45.06 92.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.512 1.125 . . . . 63.26 111.85 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -85.7 -10.73 55.2 Favored 'General case' 0 C--O 1.264 1.845 0 C-N-CA 126.407 1.883 . . . . 73.02 115.299 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' MET . . . . . . . . . . . . . 22.5 ttt -54.96 -50.25 69.37 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 116.97 -1.49 . . . . 49.29 110.876 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -34.89 79.26 Favored 'General case' 0 N--CA 1.507 2.394 0 CA-C-N 122.763 2.528 . . . . 70.98 110.236 -171.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 58' ' ' GLY . . . . . 0.695 ' HA3' ' NH2' ' D' ' 79' ' ' ARG . . . -64.99 -45.72 91.45 Favored Glycine 0 C--O 1.277 2.833 0 CA-C-N 121.778 2.081 . . . . 47.58 113.08 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 59' ' ' VAL . . . . . . . . . . . . . 82.3 t -54.18 -47.13 67.79 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 116.488 -1.72 . . . . 39.97 107.773 173.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.03 -47.99 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 118.015 -1.474 . . . . 40.63 107.673 -171.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' THR . . . . . . . . . . . . 0.261 27.6 p -72.1 -41.86 66.78 Favored 'General case' 0 C--O 1.184 -2.362 0 CA-C-O 115.841 -2.028 . . . . 54.91 107.523 -170.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 62' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -57.55 -36.06 71.14 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 121.915 2.143 . . . . 64.04 112.664 166.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.35 -31.87 40.4 Favored Glycine 0 C--O 1.182 -3.148 1 C-N-CA 112.803 -4.523 . . . . 61.13 109.919 -174.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 64' ' ' MET . . . . . . . . . . . . . 1.3 ttm -60.67 -40.56 92.54 Favored 'General case' 0 C--O 1.199 -1.587 0 CA-C-N 121.276 2.538 . . . . 107.47 108.683 174.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.61 -29.15 69.04 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 116.623 -1.656 . . . . 94.77 110.118 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -84.41 -24.31 29.67 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 120.973 1.715 . . . . 100.57 112.345 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.13 170.85 46.22 Favored Glycine 0 C--O 1.178 -3.378 0 CA-C-O 117.778 -1.568 . . . . 79.81 112.246 163.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' D' ' 42' ' ' ASN . 21.5 tp -57.29 -35.34 69.68 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 128.136 2.574 . . . . 96.96 109.794 -177.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 69' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -46.47 -48.64 19.02 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 126.141 2.151 . . . . 102.88 108.161 178.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 33.79 4.0 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 128.054 2.542 . . . . 117.11 111.749 -175.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 62.91 23.7 14.14 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-N 119.542 1.065 . . . . 106.07 111.797 168.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 49.15 38.1 12.37 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 124.781 1.232 . . . . 66.55 112.032 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' LEU . . . . . . . . . . . . . 21.4 mt -132.64 136.9 46.78 Favored 'General case' 0 C--O 1.268 2.046 0 C-N-CA 125.31 1.444 . . . . 55.67 109.06 166.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 74' ' ' LYS . . . . . 0.446 ' HB3' ' HB2' ' D' ' 77' ' ' ASP . 25.0 ttpt -50.54 127.47 24.39 Favored Pre-proline 0 C--N 1.317 -0.807 0 O-C-N 125.213 1.571 . . . . 83.9 107.874 162.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 75' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -50.38 128.99 24.7 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.626 2.217 . . . . 74.87 112.559 162.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 56.98 19.38 4.57 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 116.534 -1.698 . . . . 93.68 114.287 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' ASP . . . . . 0.446 ' HB2' ' HB3' ' D' ' 74' ' ' LYS . 23.1 t0 -40.34 110.06 0.14 Allowed 'General case' 0 C--O 1.286 3.018 0 CA-C-N 120.863 1.665 . . . . 66.99 107.454 161.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 78' ' ' SER . . . . . . . . . . . . . 2.6 p -63.6 -21.17 66.21 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 127.845 2.458 . . . . 55.74 112.642 172.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ARG . . . . . 0.695 ' NH2' ' HA3' ' D' ' 58' ' ' GLY . 86.2 mtm180 -80.07 -13.52 59.23 Favored 'General case' 0 C--O 1.17 -3.08 0 CA-C-N 120.793 1.633 . . . . 60.19 108.608 -178.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 80' ' ' VAL . . . . . . . . . . . . . 93.1 t -82.32 109.4 16.29 Favored 'Isoleucine or valine' 0 C--O 1.179 -2.657 0 N-CA-C 107.577 -1.268 . . . . 38.48 107.577 -173.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' ILE . . . . . . . . . . . . . 50.0 mt -76.75 -37.36 28.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.92 0 C-N-CA 112.962 -3.495 . . . . 41.28 105.747 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' ALA . . . . . . . . . . . . . . . -159.68 147.67 17.19 Favored 'General case' 0 N--CA 1.516 2.845 0 CA-C-N 121.481 1.946 . . . . 28.19 108.371 -176.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -153.4 158.23 41.15 Favored 'General case' 0 C--N 1.288 -2.102 0 CA-C-N 121.246 1.839 . . . . 38.87 113.576 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 3.0 p -86.23 173.3 9.87 Favored 'General case' 0 C--O 1.277 2.507 0 C-N-CA 124.638 1.175 . . . . 45.8 112.909 160.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mttp -74.16 154.17 39.21 Favored 'General case' 1 C--O 1.339 5.791 0 CA-C-N 112.705 -2.043 . . . . 97.5 106.134 171.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 86' ' ' LEU . . . . . . . . . . . . . 13.1 tp -76.5 135.77 39.33 Favored 'General case' 1 C--O 1.317 4.634 0 O-C-N 128.626 3.704 . . . . 62.35 106.765 171.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 87' ' ' ILE . . . . . . . . . . . . . 18.9 pt -132.66 146.45 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 107.06 -1.459 . . . . 60.14 107.06 -169.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' GLY . . . . . . . . . . . . . . . -113.07 -174.17 19.02 Favored Glycine 0 CA--C 1.56 2.847 0 C-N-CA 120.382 -0.913 . . . . 62.53 113.416 156.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' SER . . . . . . . . . . . . . 3.6 t -28.76 128.5 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 128.599 2.76 . . . . 81.85 111.843 -175.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 71.7 8.84 68.63 Favored Glycine 0 C--O 1.2 -1.997 0 CA-C-O 117.022 -1.988 . . . . 87.11 112.956 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -96.49 176.3 6.08 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.121 2.46 . . . . 95.57 110.565 176.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.01 160.44 41.07 Favored 'General case' 0 C--O 1.202 -1.408 0 O-C-N 124.908 1.38 . . . . 91.08 109.985 172.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -168.58 160.26 10.73 Favored 'General case' 0 C--O 1.165 -3.37 0 O-C-N 124.3 1.0 . . . . 92.81 108.661 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' SER . . . . . . . . . . . . . 1.1 t -149.04 139.86 22.79 Favored 'General case' 1 C--O 1.32 4.815 0 CA-C-O 113.938 -2.934 . . . . 85.7 108.639 -157.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 8.4 p -142.1 141.95 28.28 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.456 1 O-C-N 129.356 4.16 . . . . 45.98 108.142 176.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 96' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' D' ' 29' ' ' PHE . 85.2 m -124.45 146.82 48.7 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 104.313 -2.477 . . . . 52.15 104.313 174.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 97' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -148.35 159.27 44.17 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 104.686 -2.339 . . . . 42.51 104.686 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -77.46 125.8 29.9 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 127.691 3.12 . . . . 76.53 108.42 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' VAL . . . . . . . . . . . . . 73.7 t -68.69 -24.77 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 126.213 1.805 . . . . 59.81 108.189 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' SER . . . . . . . . . . . . . 29.6 p -55.51 -28.08 52.51 Favored 'General case' 0 C--O 1.192 -1.941 0 CA-C-O 116.733 -1.603 . . . . 64.94 112.005 171.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -67.71 -18.04 64.78 Favored 'General case' 0 C--O 1.156 -3.818 0 CA-C-O 115.947 -1.978 . . . . 60.11 109.726 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 36.3 mt -98.53 152.1 19.92 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.307 1.443 . . . . 65.21 109.905 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -131.4 142.59 50.07 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.15 -1.056 . . . . 107.61 108.15 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.36 144.21 3.04 Favored 'General case' 0 C--O 1.295 3.463 0 C-N-CA 126.221 1.808 . . . . 117.69 110.539 167.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.78 -6.65 6.12 Favored Glycine 1 C--O 1.302 4.368 0 CA-C-O 117.913 -1.493 . . . . 82.66 114.986 173.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 106' ' ' GLU . . . . . . . . . . . . 0.263 6.0 tp10 -93.01 141.6 28.21 Favored 'General case' 0 C--O 1.183 -2.44 0 CA-C-N 119.475 1.637 . . . . 83.48 108.098 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 107' ' ' GLN . . . . . . . . . . . . 0.305 0.0 OUTLIER -91.87 122.53 34.48 Favored 'General case' 1 C--O 1.344 6.072 0 CA-C-O 123.956 1.836 . . . . 56.05 106.995 -176.085 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 108' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -115.12 143.4 45.28 Favored 'General case' 1 C--O 1.361 6.962 0 N-CA-C 104.444 -2.428 . . . . 51.48 104.444 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 109' ' ' MET . . . . . . . . . . . . . 88.9 mmm -119.03 143.98 46.79 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 104.953 -2.24 . . . . 70.66 104.953 177.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' PHE . . . . . 0.424 ' HA ' ' O ' ' D' ' 49' ' ' VAL 0.278 2.4 p90 -109.57 146.7 34.25 Favored 'General case' 0 C--O 1.158 -3.733 0 N-CA-C 104.831 -2.285 . . . . 35.58 104.831 169.108 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 111' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -160.0 162.53 34.32 Favored 'General case' 0 C--O 1.172 -2.975 0 O-C-N 121.741 -0.599 . . . . 26.66 110.006 -175.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 112' ' ' CYS . . . . . . . . . . . . . 2.2 t -98.19 141.59 30.93 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 106.631 -1.618 . . . . 38.05 106.631 166.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' THR . . . . . . . . . . . . . 31.0 p -108.83 19.19 19.93 Favored 'General case' 0 C--O 1.195 -1.799 0 O-C-N 119.684 -1.885 . . . . 31.51 111.418 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -72.36 141.99 83.87 Favored Pre-proline 0 N--CA 1.5 2.056 0 CA-C-O 114.884 -2.484 . . . . 51.63 108.118 165.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -48.58 116.04 1.9 Allowed 'Trans proline' 1 C--O 1.314 4.307 1 C-N-CA 125.982 4.454 . . . . 46.54 115.763 -175.717 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.93 -5.67 81.93 Favored Glycine 1 C--O 1.133 -6.162 1 O-C-N 129.239 4.087 . . . . 43.07 109.336 171.192 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 117' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -83.72 -19.01 35.96 Favored 'General case' 0 C--O 1.273 2.296 0 CA-C-O 116.667 -1.635 . . . . 51.88 109.614 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' SER . . . . . . . . . . . . . 89.2 p -75.62 -16.66 60.19 Favored 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.068 -2.653 . . . . 40.54 111.067 -170.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.44 -51.89 63.75 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 105.692 -1.966 . . . . 52.32 105.692 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 120' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' D' ' 120' ' ' LEU . 15.2 mt -83.16 -44.59 14.9 Favored 'General case' 0 C--O 1.265 1.902 0 CA-C-O 113.989 -2.91 . . . . 81.66 112.369 177.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 121' ' ' MET . . . . . . . . . . . . . 53.4 mtp -91.96 73.28 5.61 Favored 'General case' 0 C--N 1.365 1.267 0 O-C-N 126.857 2.598 . . . . 48.72 107.315 -164.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.99 171.95 14.1 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 118.274 -2.766 . . . . 73.97 109.38 173.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 123' ' ' GLY . . . . . . . . . . . . . . . -179.05 -166.83 35.64 Favored Glycine 1 C--O 1.16 -4.485 0 O-C-N 125.74 1.9 . . . . 41.1 111.427 166.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 124' ' ' THR . . . . . . . . . . . . . 20.9 p -99.95 149.31 23.56 Favored 'General case' 1 C--O 1.317 4.639 0 C-N-CA 128.21 2.604 . . . . 53.93 105.919 -166.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 125' ' ' LEU . . . . . . . . . . . . . 2.5 tt -141.0 109.39 5.88 Favored 'General case' 0 C--O 1.288 3.13 0 N-CA-C 103.041 -2.948 . . . . 46.85 103.041 179.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 126' ' ' THR . . . . . . . . . . . . . 4.3 m -120.66 136.17 54.91 Favored 'General case' 0 C--O 1.296 3.526 1 O-C-N 129.159 4.037 . . . . 61.83 112.141 -172.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 127' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' D' ' 127' ' ' LEU . 0.1 OUTLIER -81.71 97.33 7.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 127.46 2.975 . . . . 93.41 109.434 174.286 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.368 0 C-N-CA 128.669 2.788 . . . . 122.06 109.573 -171.623 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 301' ' ' HOH . . . . . 0.456 ' O ' ' O ' ' D' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.899 0 N-CA-C 108.002 -1.11 . . . . 68.16 108.002 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 67.7 m 60.25 34.0 20.95 Favored 'General case' 0 C--O 1.276 2.468 0 C-N-CA 124.825 1.25 . . . . 57.57 113.638 175.957 -58.031 -66.683 -92.242 104.8 2.085 104.094 -79.056 -64.207 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -143.53 167.29 22.56 Favored 'General case' 0 C--O 1.18 -2.592 0 O-C-N 124.421 1.076 . . . . 49.84 110.754 173.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -146.93 142.3 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 104.425 -2.435 . . . . 43.63 104.425 175.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -101.11 118.7 37.51 Favored 'General case' 0 C--O 1.198 -1.642 0 O-C-N 126.333 2.27 . . . . 72.49 106.536 178.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.8 tt -127.4 139.78 50.95 Favored 'Isoleucine or valine' 0 C--O 1.157 -3.77 0 CA-C-N 120.864 1.666 . . . . 47.03 110.091 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -117.42 138.23 51.97 Favored 'General case' 0 C--O 1.297 3.579 0 N-CA-C 105.022 -2.214 . . . . 76.77 105.022 -177.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.66 127.2 7.6 Favored Glycine 0 N--CA 1.485 1.935 0 O-C-N 128.394 3.559 . . . . 50.76 107.503 166.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.42 ' O ' ' NE2' ' A' ' 46' ' ' HIS . 56.2 p30 -109.08 -177.19 3.24 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 119.292 1.546 . . . . 75.76 109.923 -175.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -62.51 -9.91 10.16 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 129.368 3.067 . . . . 83.12 114.497 168.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -105.14 12.19 32.33 Favored 'General case' 0 C--O 1.276 2.483 0 CA-C-N 123.105 2.684 . . . . 85.14 110.581 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 8.1 ttm 70.37 41.82 0.97 Allowed 'General case' 0 C--O 1.191 -2.0 0 N-CA-C 106.342 -1.725 . . . . 69.12 106.342 166.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -123.67 133.13 53.95 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.974 1.31 . . . . 68.46 110.838 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -86.34 145.86 26.72 Favored 'General case' 1 C--O 1.118 -5.817 0 CA-C-O 115.92 -1.99 . . . . 54.38 108.132 160.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.2 p-10 -83.3 18.05 1.89 Allowed 'General case' 0 N--CA 1.51 2.526 0 CA-C-N 123.652 2.933 . . . . 59.42 107.836 -172.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -158.39 153.58 25.56 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 116.873 -3.642 . . . . 59.76 105.849 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -138.8 10.93 2.66 Favored 'General case' 0 C--O 1.182 -2.469 0 O-C-N 124.62 1.2 . . . . 79.97 108.255 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.91 135.54 15.25 Favored 'General case' 0 C--O 1.266 1.946 0 CA-C-N 119.564 1.074 . . . . 48.47 111.283 166.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mt -123.33 132.83 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 125.524 1.529 . . . . 44.68 107.592 -178.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.338 21.2 p -112.6 123.51 50.47 Favored 'General case' 0 C--O 1.174 -2.876 0 N-CA-C 105.044 -2.206 . . . . 61.47 105.044 175.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.7 t -97.6 113.05 31.03 Favored 'Isoleucine or valine' 0 C--O 1.297 3.603 0 C-N-CA 128.235 2.614 . . . . 45.92 107.524 168.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -56.12 131.33 47.34 Favored 'General case' 0 C--O 1.283 2.852 0 O-C-N 120.695 -1.253 . . . . 74.2 108.744 172.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -12.1 61.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 117.435 -1.269 . . . . 86.18 109.594 -174.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -80.09 -20.22 45.63 Favored 'General case' 0 C--O 1.284 2.898 0 O-C-N 125.113 1.508 . . . . 71.32 109.38 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.6 m -66.67 135.82 54.62 Favored 'General case' 0 C--O 1.29 3.191 0 CA-C-N 120.127 1.331 . . . . 65.61 109.501 178.036 -64.207 -79.056 -92.242 104.094 2.085 104.8 -66.683 -58.031 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -93.03 -32.96 14.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 116.51 -1.71 . . . . 67.06 107.654 169.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -124.88 144.39 50.34 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 121.191 1.814 . . . . 67.55 111.159 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -123.71 132.41 53.82 Favored 'General case' 0 C--O 1.29 3.204 0 CA-C-N 121.761 2.073 . . . . 33.75 106.826 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.2 m -108.19 135.22 49.88 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-O 121.543 0.687 . . . . 44.53 111.18 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 77.5 t -105.69 134.12 48.11 Favored 'Isoleucine or valine' 0 C--O 1.285 2.947 0 O-C-N 120.486 -1.384 . . . . 33.02 108.623 162.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -112.46 108.91 18.21 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 107.768 -1.197 . . . . 47.22 107.768 171.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.3 tp -101.59 140.59 35.67 Favored 'General case' 0 C--O 1.285 2.962 0 N-CA-C 106.163 -1.792 . . . . 45.88 106.163 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.5 p -137.2 160.8 37.96 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 116.842 -1.551 . . . . 49.15 107.745 171.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -114.98 96.65 45.63 Favored Pre-proline 0 N--CA 1.482 1.133 0 C-N-CA 127.347 2.259 . . . . 55.37 110.118 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' O ' ' O ' ' A' ' 37' ' ' GLY . 21.5 Cg_endo -68.15 -172.4 0.42 Allowed 'Trans proline' 0 C--O 1.255 1.371 0 CA-C-N 122.457 1.913 . . . . 64.59 113.424 161.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.53 ' O ' ' O ' ' A' ' 36' ' ' PRO . . . 62.46 150.97 0.03 OUTLIER Glycine 0 N--CA 1.501 2.985 0 O-C-N 116.532 -3.855 . . . . 73.74 111.896 174.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -99.68 7.53 45.08 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 127.684 2.394 . . . . 88.49 110.633 -147.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.0 mt -90.91 137.32 26.78 Favored Pre-proline 0 N--CA 1.511 2.611 0 C-N-CA 117.927 -1.509 . . . . 67.21 109.403 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -79.61 160.68 25.1 Favored 'Trans proline' 0 C--O 1.199 -1.46 0 N-CA-C 116.389 1.65 . . . . 70.9 116.389 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.5 ttpt -53.99 -41.92 68.45 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 127.032 2.133 . . . . 62.29 111.184 -164.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -71.16 -12.38 61.45 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 117.044 -1.455 . . . . 67.32 109.504 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.1 t -111.3 -46.33 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-O 117.402 -1.285 . . . . 69.45 109.063 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.4 tpp -129.86 43.58 3.1 Favored 'General case' 0 C--O 1.282 2.808 0 C-N-CA 123.977 0.911 . . . . 63.55 109.945 -174.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -64.92 137.76 38.99 Favored Glycine 0 C--O 1.278 2.901 0 C-N-CA 121.121 -0.561 . . . . 45.99 114.233 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.42 ' NE2' ' O ' ' A' ' 10' ' ' ASN . 42.9 m-70 -130.02 142.56 50.61 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 120.217 -0.593 . . . . 40.9 109.633 175.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -136.14 172.48 12.95 Favored 'General case' 0 C--O 1.202 -1.435 0 O-C-N 126.895 2.622 . . . . 37.53 106.96 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 10.3 t90 -125.76 120.0 29.42 Favored 'General case' 0 C--O 1.168 -3.234 1 C-N-CA 131.953 4.101 . . . . 29.52 103.063 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.8 t -132.61 130.32 59.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 O-C-N 128.422 3.576 . . . . 27.91 107.57 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.9 tp -108.62 132.49 53.84 Favored 'General case' 0 C--O 1.2 -1.541 0 N-CA-C 107.23 -1.396 . . . . 32.43 107.23 177.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 94.6 p -142.61 -179.91 6.59 Favored 'General case' 0 C--O 1.28 2.688 0 N-CA-C 106.741 -1.577 . . . . 38.99 106.741 163.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.1 p -59.62 153.74 19.28 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 124.192 0.932 . . . . 43.65 110.674 160.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.99 -44.33 78.47 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.814 0.445 . . . . 45.63 111.665 168.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.12 -43.24 73.9 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.741 0.817 . . . . 48.16 111.418 176.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -83.21 -14.4 53.4 Favored 'General case' 0 C--O 1.26 1.644 0 N-CA-C 116.276 1.954 . . . . 53.12 116.276 -176.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 13.9 ttt -55.91 -46.3 78.45 Favored 'General case' 0 C--O 1.203 -1.373 0 CA-C-N 120.416 1.462 . . . . 53.84 110.904 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 306' ' ' HOH 0.253 1.2 pp0? -66.18 -38.51 88.2 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 123.973 3.079 . . . . 56.24 109.498 -172.589 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -62.75 -42.8 99.63 Favored Glycine 0 N--CA 1.504 3.198 0 N-CA-C 110.528 -1.029 . . . . 44.61 110.528 -178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 45.9 t -61.63 -51.24 75.17 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.391 0 N-CA-C 105.969 -1.863 . . . . 34.45 105.969 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.2 t -62.29 -48.62 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.491 0 CA-C-N 122.052 2.206 . . . . 31.66 107.741 -172.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.348 26.4 p -71.37 -34.22 70.24 Favored 'General case' 0 C--O 1.162 -3.515 0 CA-C-O 115.007 -2.425 . . . . 49.98 109.527 -173.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . 0.304 78.2 m-20 -67.34 -37.64 83.61 Favored 'General case' 0 N--CA 1.532 3.667 0 CA-C-N 121.108 1.776 . . . . 44.8 108.785 173.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -63.29 -47.5 87.31 Favored Glycine 0 C--N 1.383 3.157 0 O-C-N 124.811 1.319 . . . . 37.55 112.429 -179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . 0.558 ' HE1' ' SD ' ' B' ' 64' ' ' MET . 24.8 ttp -57.34 -42.83 82.71 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 118.48 1.14 . . . . 62.95 110.725 176.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.74 -23.18 67.26 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 115.449 -2.215 . . . . 49.52 110.194 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -83.79 -26.01 29.96 Favored 'General case' 0 C--O 1.265 1.877 0 CA-C-N 121.745 2.066 . . . . 45.88 112.679 -177.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.74 170.41 46.2 Favored Glycine 1 C--O 1.303 4.442 0 CA-C-N 119.912 1.233 . . . . 42.15 113.584 173.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.36 -29.96 68.06 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.32 1.848 . . . . 51.77 110.796 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -40.41 -58.13 1.62 Allowed 'General case' 0 C--O 1.194 -1.818 0 C-N-CA 124.625 1.17 . . . . 98.79 109.241 171.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.1 mmtm -100.73 24.87 8.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 127.885 2.474 . . . . 58.39 112.813 -170.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 56.4 27.51 12.16 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 122.489 1.138 . . . . 51.99 110.355 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 53.56 46.09 26.8 Favored 'General case' 1 C--O 1.315 4.55 0 O-C-N 118.144 -2.848 . . . . 40.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 59.0 mt -136.85 155.19 50.11 Favored 'General case' 0 C--O 1.186 -2.264 0 N-CA-C 108.373 -0.973 . . . . 28.46 108.373 166.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 41.4 tttt -77.34 121.08 83.94 Favored Pre-proline 0 N--CA 1.504 2.259 1 N-CA-C 99.532 -4.247 . . . . 39.5 99.532 -178.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -46.12 133.29 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.977 0 C-N-CA 123.57 2.846 . . . . 43.91 110.923 172.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 55.99 23.7 6.98 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 127.692 2.397 . . . . 63.54 112.787 173.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -44.76 107.54 0.1 Allowed 'General case' 1 C--O 1.326 5.087 0 N-CA-C 103.541 -2.763 . . . . 47.03 103.541 173.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 91.6 p -72.37 -7.87 51.95 Favored 'General case' 0 C--O 1.261 1.673 0 O-C-N 126.238 2.211 . . . . 48.55 108.432 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -83.1 -14.52 53.52 Favored 'General case' 0 C--O 1.172 -2.999 0 CA-C-N 121.247 1.84 . . . . 47.14 109.645 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 83.8 t -80.18 113.64 19.88 Favored 'Isoleucine or valine' 0 C--O 1.16 -3.646 0 O-C-N 125.351 1.657 . . . . 32.33 109.155 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.9 mt -76.21 -43.37 37.36 Favored 'Isoleucine or valine' 0 C--O 1.179 -2.618 0 C-N-CA 115.467 -2.493 . . . . 45.22 106.6 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -154.53 159.93 41.23 Favored 'General case' 0 C--O 1.154 -3.963 0 N-CA-C 107.547 -1.279 . . . . 32.05 107.547 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 14.6 p80 -160.79 150.5 17.36 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.324 -0.991 . . . . 30.94 108.324 174.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.8 p -82.6 170.64 14.94 Favored 'General case' 1 C--O 1.144 -4.486 0 N-CA-C 114.714 1.376 . . . . 30.7 114.714 158.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -54.32 151.14 7.79 Favored 'General case' 0 C--O 1.157 -3.783 0 C-N-CA 129.56 3.144 . . . . 62.98 110.141 153.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 16.4 tp -79.82 128.27 33.23 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 128.328 3.518 . . . . 46.21 104.593 171.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 33.6 pt -131.31 148.86 32.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.888 0 O-C-N 124.106 0.879 . . . . 45.04 110.207 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.42 179.18 20.26 Favored Glycine 0 C--O 1.289 3.539 0 O-C-N 126.581 2.426 . . . . 54.61 111.976 165.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.1 t -31.04 132.59 0.09 Allowed 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 126.793 2.037 . . . . 63.63 110.789 -176.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.6 -12.37 6.08 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 116.275 -2.403 . . . . 64.27 112.923 171.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -87.89 169.35 12.11 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 122.46 3.13 . . . . 65.46 108.743 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -144.15 161.01 39.94 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 115.826 -2.035 . . . . 66.24 106.306 175.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -155.9 164.48 38.44 Favored 'General case' 0 C--O 1.184 -2.357 0 O-C-N 126.378 2.298 . . . . 42.77 107.147 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.9 t -139.31 145.6 39.3 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 127.51 2.324 . . . . 46.97 107.358 -166.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.9 p -141.9 140.53 30.12 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.83 0 O-C-N 126.03 2.081 . . . . 36.85 106.837 166.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.1 m -111.29 153.6 25.69 Favored 'General case' 1 C--O 1.308 4.133 0 CA-C-O 114.391 -2.718 . . . . 35.34 106.718 168.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -148.41 158.27 44.0 Favored 'General case' 0 CA--C 1.486 -1.483 0 O-C-N 125.938 2.024 . . . . 37.21 109.202 175.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.2 130.6 36.5 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 128.2 3.437 . . . . 80.94 109.064 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 74.8 t -72.25 -22.15 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.404 0 O-C-N 121.359 -0.838 . . . . 46.99 108.985 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.0 p -53.81 -26.66 25.15 Favored 'General case' 0 N--CA 1.513 2.723 0 CA-C-O 116.445 -1.74 . . . . 51.07 111.993 168.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -69.36 -19.61 63.84 Favored 'General case' 0 C--O 1.199 -1.584 0 CA-C-N 120.608 1.549 . . . . 63.1 110.244 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.2 mt -97.9 157.2 16.23 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.267 1.027 . . . . 65.48 112.174 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.9 mtpm? -134.91 144.76 47.67 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.446 1.498 . . . . 88.41 108.423 170.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 148.87 46.97 Favored 'General case' 0 N--CA 1.506 2.359 0 N-CA-C 108.128 -1.064 . . . . 91.19 108.128 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 62.18 -1.32 1.45 Allowed Glycine 0 C--O 1.29 3.632 0 C-N-CA 127.573 2.511 . . . . 96.25 116.0 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -87.17 146.02 26.18 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 121.273 2.537 . . . . 97.53 106.564 171.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.8 124.66 39.92 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 108.121 -1.066 . . . . 57.13 108.121 -168.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -116.95 143.95 45.13 Favored 'General case' 0 C--O 1.197 -1.693 0 N-CA-C 105.892 -1.892 . . . . 47.54 105.892 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 90.8 mmm -118.9 151.76 37.53 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 116.731 -1.604 . . . . 62.21 107.606 171.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -114.5 150.74 34.39 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 115.825 -2.036 . . . . 38.41 108.686 162.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -167.18 161.38 14.49 Favored 'General case' 0 C--O 1.195 -1.766 0 CA-C-O 126.823 3.201 . . . . 33.63 109.511 -170.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . 0.252 10.8 t -96.55 138.85 33.5 Favored 'General case' 0 C--N 1.277 -2.56 0 CA-C-N 112.136 -2.302 . . . . 31.48 107.859 169.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 68.1 p -105.67 5.43 31.1 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 118.037 -1.465 . . . . 26.06 110.978 177.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -60.25 140.48 91.34 Favored Pre-proline 0 C--O 1.271 2.188 0 N-CA-C 104.204 -2.517 . . . . 36.87 104.204 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.41 114.47 1.57 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.43 3.42 . . . . 39.85 115.584 -173.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.5 5.1 75.79 Favored Glycine 1 C--O 1.152 -4.983 2 O-C-N 129.784 4.427 . . . . 43.62 106.924 167.439 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 7.7 m170 -75.76 -29.71 58.91 Favored 'General case' 1 C--O 1.309 4.198 0 CA-C-N 120.068 1.934 . . . . 41.12 109.976 -171.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.7 p -62.01 -23.41 66.42 Favored 'General case' 0 C--O 1.267 1.975 0 C-N-CA 127.688 2.395 . . . . 44.61 110.777 -171.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.23 -46.85 85.04 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 124.742 1.276 . . . . 63.25 107.724 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -92.26 -38.68 11.94 Favored 'General case' 0 N--CA 1.498 1.975 0 CA-C-N 119.748 1.158 . . . . 69.92 112.093 177.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' MET . . . . . . . . . . . . . 71.4 mtp -94.84 80.26 3.71 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.985 -1.117 . . . . 44.8 107.985 -165.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.87 172.81 17.41 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 114.652 -2.594 . . . . 64.93 106.891 176.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 176.91 177.15 45.63 Favored Glycine 0 C--O 1.281 3.086 0 C-N-CA 127.602 2.525 . . . . 43.48 107.105 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 40.2 p -101.17 145.51 28.7 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 126.53 1.932 . . . . 50.85 107.113 -171.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 6.0 tt -127.6 123.26 35.26 Favored 'General case' 0 C--O 1.186 -2.244 0 N-CA-C 107.14 -1.43 . . . . 43.69 107.14 170.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.8 m -124.4 138.57 54.35 Favored 'General case' 0 C--O 1.286 3.007 0 O-C-N 123.734 0.646 . . . . 61.6 109.846 -175.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' A' ' 127' ' ' LEU . 0.0 OUTLIER -87.18 104.04 15.99 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 114.556 -2.64 . . . . 66.62 108.521 166.864 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.518 2.955 0 C-N-CA 127.185 2.194 . . . . 90.14 110.61 -173.776 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.413 0 CA-C-O 117.458 -1.258 . . . . 84.19 108.097 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 81.5 m 60.28 27.49 17.04 Favored 'General case' 1 C--O 1.326 5.099 0 C-N-CA 125.1 1.36 . . . . 83.38 113.257 164.893 -60.221 -64.521 -94.691 102.557 2.071 106.087 -78.153 -65.99 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 62.1 p -140.72 168.78 18.98 Favored 'General case' 0 C--O 1.181 -2.53 0 O-C-N 123.511 0.507 . . . . 65.81 110.096 173.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 14.0 p -150.51 141.24 16.43 Favored 'Isoleucine or valine' 0 C--O 1.268 2.039 0 N-CA-C 105.884 -1.895 . . . . 52.79 105.884 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -101.51 119.4 38.71 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 127.093 2.745 . . . . 70.19 107.292 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 17.9 tt -127.68 143.02 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 119.043 0.838 . . . . 45.04 110.262 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -118.84 142.53 47.65 Favored 'General case' 0 C--N 1.297 -1.716 0 C-N-CA 125.295 1.438 . . . . 56.51 107.659 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.29 124.35 5.89 Favored Glycine 0 C--O 1.282 3.151 0 N-CA-C 105.928 -2.869 . . . . 48.88 105.928 171.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -109.35 -174.13 2.43 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.19 1.995 . . . . 52.23 109.092 -172.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ASP . . . . . 0.463 ' HA ' ' HG2' ' B' ' 44' ' ' MET . 95.2 m-20 -67.59 -18.34 64.95 Favored 'General case' 0 C--O 1.274 2.351 0 C-N-CA 130.195 3.398 . . . . 73.47 113.249 174.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -86.4 10.73 14.2 Favored 'General case' 0 N--CA 1.514 2.727 0 N-CA-C 116.416 2.006 . . . . 84.29 116.416 165.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' MET . . . . . 0.483 ' HB2' ' HE1' ' B' ' 44' ' ' MET . 48.3 ttm 67.66 43.98 1.74 Allowed 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 105.029 -2.212 . . . . 70.47 105.029 172.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -124.17 153.19 41.92 Favored 'General case' 0 C--O 1.186 -2.258 0 CA-C-N 115.357 -0.838 . . . . 64.42 111.866 173.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -101.23 151.97 21.22 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 104.205 -2.517 . . . . 44.2 104.205 165.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 29.1 p-10 -87.86 7.31 31.3 Favored 'General case' 0 C--O 1.3 3.75 0 O-C-N 120.681 -1.262 . . . . 45.15 107.922 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' THR . . . . . . . . . . . . . 5.2 t -146.35 152.01 38.42 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 116.797 -1.573 . . . . 42.56 108.053 172.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 42.4 p30 -117.96 5.39 12.12 Favored 'General case' 0 C--O 1.16 -3.655 0 CA-C-O 115.385 -2.245 . . . . 47.89 112.012 173.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.07 113.88 1.05 Allowed 'General case' 1 C--O 1.308 4.183 0 CA-C-O 125.113 2.387 . . . . 46.73 111.354 -167.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 60.9 mt -114.3 131.79 65.27 Favored 'Isoleucine or valine' 0 C--O 1.25 1.093 0 CA-C-N 112.736 -2.029 . . . . 48.1 107.915 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 69.5 p -115.27 118.93 34.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 126.911 2.632 . . . . 58.34 106.723 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 92.3 t -102.3 108.44 23.96 Favored 'Isoleucine or valine' 0 C--O 1.288 3.11 0 O-C-N 126.26 2.225 . . . . 66.41 107.568 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -48.26 127.07 12.2 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-O 117.87 -1.062 . . . . 90.59 112.182 168.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -13.8 61.73 Favored 'General case' 0 N--CA 1.515 2.798 0 C-N-CA 124.836 1.254 . . . . 106.7 110.706 -177.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.6 p -78.3 -23.54 47.09 Favored 'General case' 0 C--O 1.258 1.516 0 C-N-CA 126.158 1.783 . . . . 86.62 110.141 175.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.79 134.38 55.16 Favored 'General case' 0 C--O 1.287 3.042 0 CA-C-N 120.075 1.307 . . . . 86.17 108.49 176.161 -65.99 -78.153 -94.691 106.087 2.071 102.557 -64.521 -60.221 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -89.5 -31.03 17.85 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 115.956 -1.973 . . . . 93.77 107.351 168.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 11.5 mp0 -123.67 144.39 49.67 Favored 'General case' 0 C--O 1.18 -2.579 0 CA-C-O 113.862 -2.97 . . . . 77.57 112.238 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . 0.255 61.7 t80 -126.66 131.47 51.42 Favored 'General case' 0 N--CA 1.507 2.409 0 CA-C-N 121.882 2.128 . . . . 54.74 106.973 -179.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 40.5 m -113.83 131.98 56.05 Favored 'General case' 0 C--O 1.178 -2.683 0 CA-C-O 122.86 1.314 . . . . 54.17 108.402 -177.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -110.07 127.61 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 C-N-CA 124.869 1.268 . . . . 43.01 109.542 168.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -109.06 106.46 16.4 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 115.293 -2.289 . . . . 48.28 108.808 171.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -94.13 132.58 38.51 Favored 'General case' 0 C--O 1.283 2.826 0 O-C-N 128.689 3.743 . . . . 42.26 108.559 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 56.6 p -126.36 157.58 38.11 Favored 'General case' 0 CA--C 1.555 1.154 0 O-C-N 125.363 1.665 . . . . 45.23 109.643 167.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -113.66 96.9 42.35 Favored Pre-proline 0 C--O 1.254 1.33 0 O-C-N 127.15 2.781 . . . . 56.29 110.828 170.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PRO . . . . . 0.523 ' O ' ' O ' ' B' ' 37' ' ' GLY . 42.5 Cg_endo -70.6 -170.6 0.46 Allowed 'Trans proline' 0 C--N 1.377 2.046 0 CA-C-N 122.647 1.981 . . . . 58.65 112.016 161.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLY . . . . . 0.523 ' O ' ' O ' ' B' ' 36' ' ' PRO . . . 61.01 155.2 0.04 OUTLIER Glycine 0 N--CA 1.508 3.484 0 C-N-CA 115.507 -3.235 . . . . 61.53 112.341 177.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASN . . . . . . . . . . . . . 23.6 m-20 -101.92 3.31 38.97 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 127.457 2.303 . . . . 74.18 110.518 -144.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 16.3 mt -91.92 143.21 27.4 Favored Pre-proline 0 C--O 1.246 0.897 0 C-N-CA 117.026 -1.87 . . . . 65.84 106.754 -167.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -87.73 165.2 7.61 Favored 'Trans proline' 0 C--N 1.358 1.052 0 CA-C-N 114.207 -1.033 . . . . 67.69 114.105 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -58.01 -38.52 76.32 Favored 'General case' 0 CA--C 1.596 2.719 0 O-C-N 125.54 1.775 . . . . 56.24 110.559 -161.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -73.92 -12.12 60.56 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-N 121.266 1.848 . . . . 72.08 109.73 -176.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 2.3 t -107.76 -44.04 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 CA-C-N 119.172 0.896 . . . . 70.03 109.742 -176.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' MET . . . . . 0.483 ' HE1' ' HB2' ' B' ' 13' ' ' MET . 25.9 tpp -134.19 41.47 2.96 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.633 1.173 . . . . 60.31 110.038 -173.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.9 133.69 52.38 Favored Glycine 1 C--O 1.297 4.044 0 CA-C-O 118.593 -1.115 . . . . 50.79 114.038 175.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' HIS . . . . . 0.413 ' CE1' ' SD ' ' B' ' 121' ' ' MET . 26.0 m-70 -125.54 145.42 50.12 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 126.229 1.782 . . . . 40.67 108.673 172.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASN . . . . . . . . . . . . . 32.7 p30 -139.35 176.36 8.78 Favored 'General case' 1 C--O 1.152 -4.059 0 O-C-N 128.372 3.545 . . . . 34.62 103.102 165.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -138.8 116.31 11.3 Favored 'General case' 0 CA--C 1.474 -1.949 0 N-CA-C 102.357 -3.201 . . . . 34.93 102.357 -177.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' B' ' 110' ' ' PHE . 58.9 t -133.28 131.92 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 O-C-N 127.265 2.853 . . . . 37.94 103.597 -169.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . 0.271 49.1 tp -109.55 129.44 55.57 Favored 'General case' 0 C--O 1.178 -2.682 0 C-N-CA 126.071 1.748 . . . . 44.41 109.451 174.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' SER . . . . . . . . . . . . . 87.4 p -144.32 175.33 10.18 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.88 2.072 . . . . 47.78 107.074 169.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 29.5 p -62.38 153.86 29.86 Favored 'General case' 1 C--O 1.315 4.505 0 N-CA-C 109.416 -0.587 . . . . 55.68 109.416 165.172 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.52 -37.84 68.45 Favored 'General case' 0 C--O 1.284 2.918 0 N-CA-C 115.86 1.8 . . . . 56.92 115.86 167.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.03 -38.63 89.42 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-O 122.538 1.161 . . . . 64.49 111.521 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -83.72 -13.26 54.42 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 113.525 -3.131 . . . . 73.45 113.7 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' MET . . . . . . . . . . . . . 6.4 ttt -55.56 -45.64 77.28 Favored 'General case' 0 C--N 1.366 1.294 0 CA-C-N 122.068 2.213 . . . . 53.2 111.8 -173.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLN . . . . . 0.925 HE21 HG23 ' B' ' 61' ' ' THR . 32.9 tp60 -66.28 -42.88 87.78 Favored 'General case' 0 C--O 1.271 2.202 0 CA-C-N 122.36 2.345 . . . . 77.9 109.398 -170.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -60.04 -46.68 93.75 Favored Glycine 0 N--CA 1.505 3.29 0 CA-C-O 119.244 -0.753 . . . . 56.99 113.567 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 94.0 t -50.88 -53.04 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.315 0 CA-C-O 115.857 -2.02 . . . . 51.42 108.867 168.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 37.1 t -66.24 -48.19 81.98 Favored 'Isoleucine or valine' 0 C--O 1.273 2.309 0 CA-C-N 121.064 1.757 . . . . 48.95 108.701 -172.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' THR . . . . . 0.925 HG23 HE21 ' B' ' 57' ' ' GLN 0.307 33.6 p -70.83 -39.06 73.21 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 116.247 -1.835 . . . . 62.51 107.154 -172.931 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -66.03 -32.41 73.87 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 122.315 2.325 . . . . 74.79 109.232 174.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.84 -53.02 49.77 Favored Glycine 0 C--O 1.196 -2.273 0 O-C-N 120.543 -1.348 . . . . 54.33 113.815 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' MET . . . . . 0.558 ' SD ' ' HE1' ' A' ' 64' ' ' MET . 66.3 ttp -61.8 -37.43 84.35 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 123.145 0.578 . . . . 93.75 110.091 -179.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -27.6 68.98 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 118.627 0.649 . . . . 66.78 109.931 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.14 -24.02 30.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 116.292 -1.813 . . . . 62.99 112.781 -174.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.24 170.38 46.11 Favored Glycine 0 C--O 1.201 -1.935 0 O-C-N 124.371 1.044 . . . . 57.01 114.091 172.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 26.3 tp -58.49 -31.82 68.22 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 126.672 1.989 . . . . 60.79 110.891 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.55 -41.64 54.29 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-O 115.686 -2.102 . . . . 103.9 107.623 179.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm -109.03 32.46 4.91 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 128.128 2.571 . . . . 60.4 113.253 -179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 53.49 29.43 9.0 Favored 'General case' 0 N--CA 1.513 2.724 0 CA-C-N 120.637 1.562 . . . . 52.57 115.067 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 50.77 45.66 26.91 Favored 'General case' 0 C--O 1.267 2.0 0 C-N-CA 123.974 0.91 . . . . 48.45 112.997 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 18.4 mt -143.73 136.39 27.23 Favored 'General case' 0 C--O 1.156 -3.848 0 O-C-N 125.567 1.792 . . . . 53.03 108.847 176.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -78.91 130.37 70.35 Favored Pre-proline 0 C--N 1.301 -1.542 0 N-CA-C 101.713 -3.44 . . . . 59.92 101.713 -174.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -55.38 128.28 29.77 Favored 'Trans proline' 0 C--O 1.283 2.755 0 C-N-CA 123.32 2.68 . . . . 64.98 112.442 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 55.9 27.56 11.24 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 126.043 2.09 . . . . 87.04 113.189 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -41.65 110.62 0.17 Allowed 'General case' 0 C--O 1.254 1.339 0 C-N-CA 126.344 1.858 . . . . 59.96 106.79 155.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 91.7 p -71.9 -6.84 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 124.366 1.041 . . . . 66.36 111.094 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -85.04 -14.38 47.51 Favored 'General case' 0 CA--C 1.557 1.246 0 O-C-N 120.213 -1.555 . . . . 61.7 107.578 -176.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' VAL . . . . . . . . . . . . . 87.7 t -84.67 111.83 20.93 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.897 0 CA-C-O 122.693 1.235 . . . . 58.41 109.283 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 97.1 mt -71.24 -41.3 74.85 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.498 0 C-N-CA 114.866 -2.734 . . . . 69.44 109.361 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -164.78 151.3 10.64 Favored 'General case' 0 C--O 1.261 1.702 0 CA-C-N 120.255 1.388 . . . . 55.4 107.369 -172.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -160.61 149.31 16.68 Favored 'General case' 0 C--O 1.263 1.796 0 CA-C-O 115.669 -2.11 . . . . 44.58 108.996 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 17.8 p -80.87 170.47 16.23 Favored 'General case' 0 C--O 1.182 -2.496 0 O-C-N 126.714 2.509 . . . . 42.08 112.289 160.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.4 mttp -58.54 155.46 12.23 Favored 'General case' 0 C--O 1.171 -3.051 0 C-N-CA 129.755 3.222 . . . . 72.4 106.885 163.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -81.55 133.31 35.37 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 125.739 1.899 . . . . 44.99 106.076 165.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 22.3 pt -134.81 146.4 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 N-CA-C 105.877 -1.898 . . . . 47.86 105.877 -170.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . -109.13 -178.19 21.43 Favored Glycine 0 CA--C 1.537 1.423 0 O-C-N 125.803 1.94 . . . . 57.08 113.128 164.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 16.8 t -28.26 130.31 0.06 Allowed 'General case' 0 C--O 1.275 2.415 0 C-N-CA 127.125 2.17 . . . . 65.67 111.539 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 88.23 -21.7 23.21 Favored Glycine 0 C--N 1.351 1.365 0 CA-C-O 116.257 -2.413 . . . . 59.81 111.754 172.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -92.4 171.15 9.23 Favored 'General case' 0 N--CA 1.502 2.139 0 CA-C-N 120.387 2.093 . . . . 64.14 112.442 -168.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.89 166.58 28.14 Favored 'General case' 0 C--O 1.153 -3.975 0 O-C-N 119.681 -1.887 . . . . 60.28 111.504 169.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -164.38 156.15 16.12 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.498 -1.667 . . . . 57.87 106.498 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . 0.279 0.3 OUTLIER -135.26 153.89 51.75 Favored 'General case' 0 C--O 1.184 -2.373 0 CA-C-N 111.949 -2.387 . . . . 53.47 107.53 -165.727 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.22 139.28 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 N-CA-C 107.251 -1.389 . . . . 47.22 107.251 173.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 90.9 m -118.51 141.84 48.17 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 127.565 3.041 . . . . 56.38 106.151 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -144.52 158.55 43.71 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 126.561 2.413 . . . . 59.67 106.454 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.1 124.93 28.63 Favored 'General case' 0 C--N 1.307 -1.259 0 O-C-N 126.14 2.15 . . . . 92.51 108.214 176.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.69 -25.86 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 125.265 1.426 . . . . 78.67 108.395 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 84.8 p -54.79 -27.1 39.04 Favored 'General case' 0 C--O 1.179 -2.647 0 C-N-CA 125.211 1.404 . . . . 88.89 111.43 171.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -70.1 -13.64 62.3 Favored 'General case' 0 C--O 1.194 -1.82 0 CA-C-O 115.352 -2.261 . . . . 92.71 110.7 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 54.5 mt -99.86 144.45 28.91 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-N 119.985 1.266 . . . . 86.31 110.078 177.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' B' ' 103' ' ' LYS . 30.5 mtpt -135.55 143.01 45.47 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 114.646 -2.597 . . . . 111.0 108.483 -173.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.53 146.58 51.4 Favored 'General case' 0 C--O 1.292 3.333 0 O-C-N 126.3 2.25 . . . . 116.96 108.305 -170.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 60.58 18.64 52.32 Favored Glycine 0 C--O 1.287 3.462 0 O-C-N 125.283 1.614 . . . . 92.24 114.802 174.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -97.43 147.7 23.95 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 106.041 -1.837 . . . . 87.27 106.041 156.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -96.06 126.11 41.06 Favored 'General case' 1 C--O 1.323 4.96 0 CA-C-O 115.858 -2.02 . . . . 69.16 106.938 -175.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -110.72 140.83 44.76 Favored 'General case' 0 C--O 1.175 -2.817 0 O-C-N 126.631 2.457 . . . . 69.31 110.752 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' MET . . . . . . . . . . . . . 92.7 mmm -122.05 139.19 54.01 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 105.887 -1.894 . . . . 56.64 105.887 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' B' ' 49' ' ' VAL 0.256 12.8 p90 -101.7 149.02 24.57 Favored 'General case' 0 C--O 1.167 -3.247 0 O-C-N 124.328 1.017 . . . . 39.92 109.317 162.861 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -163.88 159.6 21.21 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 108.108 -1.071 . . . . 38.44 108.108 -177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' CYS . . . . . . . . . . . . . 37.0 t -94.81 136.36 35.21 Favored 'General case' 0 C--O 1.187 -2.205 0 CA-C-O 115.977 -1.963 . . . . 40.17 108.266 167.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 77.6 p -103.72 9.96 36.92 Favored 'General case' 0 C--O 1.184 -2.388 0 C-N-CA 127.996 2.518 . . . . 39.46 110.361 -175.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -64.51 142.69 98.48 Favored Pre-proline 0 C--N 1.306 -1.305 0 N-CA-C 104.279 -2.489 . . . . 43.46 104.279 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' PRO . . . . . 0.547 ' HB3' ' HE1' ' A' ' 64' ' ' MET . 11.0 Cg_exo -56.64 109.04 0.39 Allowed 'Trans proline' 0 C--O 1.19 -1.911 0 C-N-CA 122.608 2.205 . . . . 46.88 114.862 -176.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 97.59 7.32 56.88 Favored Glycine 1 C--O 1.306 4.6 2 C-N-CA 135.806 6.431 . . . . 48.35 110.594 168.007 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -82.23 -18.45 42.49 Favored 'General case' 1 C--O 1.141 -4.652 0 C-N-CA 115.309 -2.557 . . . . 53.09 110.572 -171.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' SER . . . . . . . . . . . . . 2.7 p -73.28 -21.81 60.52 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 118.623 -2.548 . . . . 68.77 108.759 -168.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -51.96 -59.81 3.91 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 121.302 1.864 . . . . 62.23 109.861 169.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 1.5 mt -87.45 -32.79 19.31 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 117.282 -1.342 . . . . 60.27 111.294 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' MET . . . . . 0.413 ' SD ' ' CE1' ' B' ' 46' ' ' HIS . 96.0 mtp -100.24 80.5 2.27 Favored 'General case' 1 C--O 1.091 -7.263 0 N-CA-C 105.419 -2.067 . . . . 47.09 105.419 -161.019 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.91 159.88 37.02 Favored 'General case' 0 CA--C 1.497 -1.058 0 N-CA-C 106.908 -1.515 . . . . 67.13 106.908 -178.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -169.51 -170.58 34.19 Favored Glycine 0 C--O 1.214 -1.097 0 O-C-N 126.793 2.558 . . . . 44.66 108.128 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 41.0 p -99.56 143.47 29.76 Favored 'General case' 0 C--N 1.307 -1.243 0 C-N-CA 126.547 1.939 . . . . 51.12 107.289 -174.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 4.5 tt -124.29 120.42 32.14 Favored 'General case' 0 CA--C 1.488 -1.415 0 O-C-N 124.724 1.265 . . . . 51.35 108.349 166.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -123.98 144.02 50.06 Favored 'General case' 1 C--O 1.309 4.215 0 O-C-N 127.359 2.912 . . . . 63.41 111.413 -173.021 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' B' ' 127' ' ' LEU . 0.9 OUTLIER -81.53 97.57 7.88 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 109.428 -3.533 . . . . 89.54 111.524 171.656 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.301 3.793 1 CA-C-O 134.253 6.739 . . . . 96.58 106.979 -173.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.548 4.474 0 N-CA-C 109.654 -0.499 . . . . 64.45 109.654 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' CYS . . . . . . . . . . . . . 47.9 m 55.12 19.5 2.85 Favored 'General case' 0 N--CA 1.513 2.7 0 N-CA-C 115.576 1.695 . . . . 73.67 115.576 175.78 -53.007 -56.867 -86.667 106.482 2.111 103.885 -83.395 -60.53 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' SER . . . . . . . . . . . . . 80.5 p -136.11 170.86 15.33 Favored 'General case' 0 C--O 1.195 -1.777 0 CA-C-N 120.466 1.485 . . . . 55.55 110.397 168.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' VAL . . . . . . . . . . . . . 14.4 p -150.65 140.93 16.14 Favored 'Isoleucine or valine' 0 C--O 1.272 2.277 0 N-CA-C 104.368 -2.456 . . . . 61.9 104.368 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -104.14 119.37 38.8 Favored 'General case' 0 C--O 1.256 1.395 0 O-C-N 126.387 2.305 . . . . 89.51 106.124 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ILE . . . . . 0.435 HD11 HD11 ' C' ' 20' ' ' ILE . 50.2 mt -129.48 144.19 38.84 Favored 'Isoleucine or valine' 0 C--O 1.164 -3.398 0 CA-C-N 119.38 0.991 . . . . 73.38 109.047 -175.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -123.63 136.16 54.34 Favored 'General case' 0 C--O 1.202 -1.434 0 N-CA-C 102.369 -3.197 . . . . 75.57 102.369 -173.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.33 130.6 9.68 Favored Glycine 0 C--O 1.26 1.744 0 O-C-N 128.437 3.586 . . . . 71.14 107.703 159.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ASN . . . . . . . . . . . . . 52.2 p30 -110.33 -171.89 1.92 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 119.126 1.463 . . . . 72.73 110.022 -174.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -68.73 -10.74 58.25 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 126.418 2.324 . . . . 105.84 113.638 173.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -103.95 16.7 25.71 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 122.225 2.284 . . . . 92.28 110.705 173.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' MET . . . . . . . . . . . . . 3.2 ttm 65.34 41.09 4.48 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 107.957 -1.127 . . . . 83.3 107.957 171.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -119.37 129.71 54.96 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 125.014 1.326 . . . . 75.16 109.472 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -83.86 146.86 27.86 Favored 'General case' 0 C--O 1.166 -3.311 0 N-CA-C 107.197 -1.409 . . . . 60.46 107.197 162.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ASN . . . . . . . . . . . . . 39.5 p-10 -78.44 11.57 2.39 Favored 'General case' 0 C--O 1.176 -2.8 0 CA-C-N 120.818 1.645 . . . . 72.53 108.212 -178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' THR . . . . . . . . . . . . . 3.7 t -156.62 154.61 30.45 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 106.851 -1.537 . . . . 65.22 106.851 172.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 53.6 p30 -131.95 17.75 4.63 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 125.593 1.808 . . . . 85.39 108.491 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -160.73 130.33 4.97 Favored 'General case' 0 C--O 1.159 -3.693 0 CA-C-O 117.093 -1.432 . . . . 58.61 111.9 174.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ILE . . . . . 0.435 HD11 HD11 ' C' ' 7' ' ' ILE . 79.5 mt -125.35 140.36 48.52 Favored 'Isoleucine or valine' 0 C--O 1.281 2.737 0 C-N-CA 126.825 2.05 . . . . 48.48 106.733 -176.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' THR . . . . . . . . . . . . . 81.6 p -124.81 129.38 50.32 Favored 'General case' 0 C--O 1.279 2.607 0 N-CA-C 103.282 -2.858 . . . . 67.91 103.282 179.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 62.7 t -109.09 109.33 27.97 Favored 'Isoleucine or valine' 0 C--O 1.273 2.31 0 O-C-N 126.719 2.512 . . . . 54.31 104.341 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -50.38 127.42 17.37 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 126.506 2.379 . . . . 97.75 110.018 168.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -74.14 -7.82 53.96 Favored 'General case' 0 C--O 1.275 2.409 0 CA-C-O 117.128 -1.415 . . . . 88.86 109.595 -175.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 82.7 p -74.11 -25.88 60.03 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 117.549 -1.215 . . . . 59.42 111.384 167.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' CYS . . . . . . . . . . . . . 79.4 m -63.96 132.76 51.64 Favored 'General case' 0 C--O 1.298 3.613 0 CA-C-N 119.927 1.24 . . . . 64.08 110.621 177.661 -60.53 -83.395 -86.667 103.885 2.111 106.482 -56.867 -53.007 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -90.78 -31.61 16.44 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 116.601 -1.666 . . . . 58.37 108.388 170.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -131.53 149.97 52.32 Favored 'General case' 1 C--O 1.316 4.558 0 CA-C-N 120.469 1.486 . . . . 55.6 110.631 174.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -126.0 140.35 52.68 Favored 'General case' 0 C--O 1.271 2.228 0 N-CA-C 106.219 -1.771 . . . . 47.15 106.219 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 29.7 m -119.51 135.57 54.71 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.876 1.36 . . . . 52.14 111.311 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' VAL . . . . . . . . . . . . . 28.3 t -116.28 127.11 73.98 Favored 'Isoleucine or valine' 0 C--O 1.305 3.986 0 CA-C-O 117.59 -1.195 . . . . 50.43 108.099 172.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -112.82 112.14 23.42 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 126.957 2.661 . . . . 68.87 107.505 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' LEU . . . . . . . . . . . . . 24.7 tp -101.1 139.44 36.78 Favored 'General case' 1 C--O 1.346 6.143 0 O-C-N 127.125 2.765 . . . . 59.13 106.863 -178.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' SER . . . . . . . . . . . . . 4.2 p -135.4 156.5 48.83 Favored 'General case' 0 N--CA 1.503 2.189 0 CA-C-O 117.223 -1.37 . . . . 63.88 107.906 175.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -118.31 94.93 47.89 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 126.622 2.451 . . . . 80.17 109.194 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' PRO . . . . . 0.562 ' O ' ' O ' ' C' ' 37' ' ' GLY . 54.6 Cg_endo -69.06 -174.44 0.77 Allowed 'Trans proline' 0 C--N 1.368 1.565 0 CA-C-N 121.938 1.728 . . . . 94.7 112.693 160.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' GLY . . . . . 0.562 ' O ' ' O ' ' C' ' 36' ' ' PRO . . . 57.36 157.34 0.01 OUTLIER Glycine 0 C--O 1.271 2.421 0 O-C-N 119.522 -1.986 . . . . 99.79 111.602 -179.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 m-20 -99.54 9.35 43.36 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 126.077 1.751 . . . . 114.56 111.891 -148.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 mt -91.02 141.84 26.86 Favored Pre-proline 0 N--CA 1.475 0.786 0 C-N-CA 118.441 -1.304 . . . . 91.64 107.88 -170.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -80.68 161.18 21.8 Favored 'Trans proline' 0 C--O 1.201 -1.34 0 N-CA-C 116.405 1.656 . . . . 88.78 116.405 174.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -53.41 -41.37 65.94 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 128.214 2.606 . . . . 78.0 110.626 -167.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -71.81 -12.37 61.26 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 120.264 1.393 . . . . 85.45 110.306 -174.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.37 -46.12 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 C-N-CA 124.638 1.175 . . . . 94.66 109.288 -171.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' MET . . . . . . . . . . . . . 30.2 tpp -133.42 39.81 3.2 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 125.577 1.551 . . . . 96.68 108.911 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.71 139.56 46.93 Favored Glycine 0 C--O 1.285 3.343 0 O-C-N 123.174 0.296 . . . . 69.77 112.914 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -129.66 141.56 50.9 Favored 'General case' 0 C--O 1.271 2.209 0 N-CA-C 107.956 -1.127 . . . . 56.33 107.956 171.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASN . . . . . . . . . . . . . 56.4 p30 -134.1 170.36 15.78 Favored 'General case' 0 C--O 1.261 1.695 0 C-N-CA 126.996 2.118 . . . . 45.31 107.563 164.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -127.08 118.9 25.32 Favored 'General case' 0 C--O 1.177 -2.726 0 CA-C-O 115.576 -2.154 . . . . 40.9 106.076 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 48.4 t -131.03 124.02 55.08 Favored 'Isoleucine or valine' 1 C--O 1.137 -4.818 0 O-C-N 126.28 2.238 . . . . 39.74 106.855 -175.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 31.1 tp -99.97 128.67 46.03 Favored 'General case' 0 C--N 1.282 -2.361 0 C-N-CA 127.215 2.206 . . . . 32.02 108.23 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' SER . . . . . . . . . . . . . 59.3 p -136.62 176.33 8.8 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 125.909 1.684 . . . . 34.56 108.024 162.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' THR . . . . . . . . . . . . . 30.8 p -56.97 150.7 16.25 Favored 'General case' 0 C--N 1.276 -2.602 0 C-N-CA 125.038 1.335 . . . . 39.36 108.439 158.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.52 -42.36 78.28 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-O 117.301 -1.333 . . . . 42.14 110.22 167.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.67 -41.31 81.3 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 119.595 1.088 . . . . 54.0 111.935 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -82.5 -12.99 57.41 Favored 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 117.334 2.346 . . . . 53.83 117.334 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' MET . . . . . . . . . . . . . 21.4 ttt -53.5 -52.88 58.16 Favored 'General case' 0 C--O 1.203 -1.371 0 CA-C-O 116.434 -1.746 . . . . 59.51 112.589 -173.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -61.49 -36.16 79.69 Favored 'General case' 0 N--CA 1.508 2.461 0 CA-C-N 122.76 2.527 . . . . 85.3 108.78 -169.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' GLY . . . . . . . . . . . . . . . -66.79 -45.98 79.02 Favored Glycine 0 C--O 1.278 2.887 0 CA-C-N 120.74 1.609 . . . . 48.77 112.095 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' VAL . . . . . . . . . . . . . 53.6 t -58.26 -48.14 85.64 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.596 0 N-CA-C 106.127 -1.805 . . . . 47.4 106.127 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.6 -48.19 85.88 Favored 'Isoleucine or valine' 0 C--O 1.29 3.201 0 CA-C-N 121.881 2.128 . . . . 52.67 110.01 -171.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' THR . . . . . . . . . . . . 0.3 40.0 p -70.32 -40.49 74.14 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 114.392 -2.718 . . . . 72.55 108.134 -174.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -64.67 -39.23 93.32 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 107.156 -1.424 . . . . 67.86 107.156 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' GLY . . . . . . . . . . . . . . . -67.93 -43.75 81.5 Favored Glycine 0 N--CA 1.481 1.634 0 C-N-CA 118.669 -1.729 . . . . 56.48 112.117 -175.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' MET . . . . . . . . . . . . . 38.5 ttp -58.44 -41.16 84.47 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.683 1.242 . . . . 101.0 108.975 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.29 -27.87 67.64 Favored 'General case' 0 C--O 1.196 -1.734 0 O-C-N 124.513 1.133 . . . . 70.97 111.061 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -85.25 -25.23 27.4 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-N 121.215 1.825 . . . . 67.48 112.554 -173.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 87.32 172.14 47.76 Favored Glycine 0 N--CA 1.476 1.313 0 CA-C-O 117.803 -1.554 . . . . 62.74 113.84 164.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' LEU . . . . . . . . . . . . . 30.0 tp -59.44 -35.29 73.76 Favored 'General case' 0 C--O 1.292 3.302 0 C-N-CA 126.628 1.971 . . . . 71.03 110.97 -167.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -50.43 -47.8 56.56 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 127.621 3.075 . . . . 101.89 109.498 178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -96.24 17.77 15.11 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 126.801 2.04 . . . . 75.64 110.405 -167.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 60.32 23.55 13.01 Favored 'General case' 0 N--CA 1.504 2.233 0 CA-C-O 117.293 -1.337 . . . . 75.1 109.386 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 61.41 43.27 10.64 Favored 'General case' 0 C--O 1.215 -0.728 0 O-C-N 124.904 1.377 . . . . 56.94 109.006 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' LEU . . . . . . . . . . . . . 13.6 mt -133.88 142.58 47.84 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-O 116.776 -1.583 . . . . 53.66 109.515 167.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -57.1 123.88 62.57 Favored Pre-proline 0 C--O 1.206 -1.195 0 O-C-N 127.187 2.804 . . . . 85.29 106.861 165.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -46.28 132.97 15.55 Favored 'Trans proline' 0 C--O 1.273 2.244 0 C-N-CA 124.503 3.469 . . . . 76.04 112.966 163.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 52.26 26.32 3.93 Favored 'General case' 0 C--O 1.27 2.137 0 C-N-CA 125.397 1.479 . . . . 92.29 114.636 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -49.29 110.42 0.37 Allowed 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.225 -1.769 . . . . 62.68 106.225 171.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' SER . . . . . . . . . . . . . 84.7 p -67.77 -14.82 63.27 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 124.833 1.333 . . . . 62.41 110.822 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -79.34 -16.62 56.02 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 123.802 0.689 . . . . 62.98 109.911 -178.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' VAL . . . . . . . . . . . . . 94.9 t -80.78 112.88 19.38 Favored 'Isoleucine or valine' 0 C--O 1.175 -2.833 0 CA-C-O 122.095 0.95 . . . . 39.19 109.665 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' ILE . . . . . . . . . . . . . 87.7 mt -73.23 -42.69 58.0 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.217 0 O-C-N 119.76 -1.837 . . . . 44.8 106.671 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' ALA . . . . . . . . . . . . . . . -161.75 158.35 25.65 Favored 'General case' 0 C--O 1.265 1.897 0 N-CA-C 105.319 -2.104 . . . . 32.27 105.319 -174.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -159.67 152.53 21.67 Favored 'General case' 0 C--O 1.161 -3.572 0 O-C-N 118.688 -2.508 . . . . 42.07 110.909 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' THR . . . . . . . . . . . . . 16.0 p -84.34 166.65 17.24 Favored 'General case' 0 C--O 1.187 -2.208 0 O-C-N 123.975 0.797 . . . . 42.89 110.58 161.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' LYS . . . . . . . . . . . . . 28.4 mttp -56.69 156.96 5.78 Favored 'General case' 0 C--N 1.287 -2.128 0 C-N-CA 131.105 3.762 . . . . 82.23 109.706 156.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 24.2 tp -81.88 133.16 35.3 Favored 'General case' 0 C--O 1.171 -3.062 0 CA-C-O 114.283 -2.77 . . . . 67.94 109.38 172.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' ILE . . . . . . . . . . . . . 5.8 pt -133.32 145.28 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 125.166 1.541 . . . . 65.98 110.786 -170.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.96 178.86 18.97 Favored Glycine 0 N--CA 1.475 1.252 0 O-C-N 124.535 1.147 . . . . 76.59 113.335 168.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -34.54 129.92 0.39 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 127.51 2.324 . . . . 93.24 110.659 -172.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 74.22 -2.08 46.22 Favored Glycine 0 C--O 1.18 -3.265 0 CA-C-O 116.638 -2.201 . . . . 84.82 114.03 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -84.93 171.97 11.74 Favored 'General case' 0 C--O 1.268 2.078 0 CA-C-N 121.233 2.516 . . . . 82.27 110.42 173.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -150.93 154.61 37.48 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 107.363 -1.347 . . . . 87.76 107.363 170.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -153.95 158.42 40.64 Favored 'General case' 0 C--O 1.2 -1.541 0 O-C-N 125.181 1.55 . . . . 66.04 107.611 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' SER . . . . . . . . . . . . . 1.9 t -140.21 146.17 38.36 Favored 'General case' 0 C--O 1.283 2.862 0 C-N-CA 125.638 1.575 . . . . 58.62 107.262 -163.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.21 144.07 21.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.503 0 N-CA-C 106.225 -1.769 . . . . 45.77 106.225 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' THR . . . . . . . . . . . . . 98.1 m -125.4 142.57 51.43 Favored 'General case' 0 CA--C 1.486 -1.501 0 N-CA-C 103.763 -2.681 . . . . 48.11 103.763 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -143.87 159.71 42.07 Favored 'General case' 0 C--O 1.278 2.575 0 O-C-N 126.23 2.206 . . . . 40.2 106.598 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -79.11 125.52 29.52 Favored 'General case' 1 C--O 1.333 5.454 0 O-C-N 126.331 2.269 . . . . 68.88 108.517 174.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . . 43.3 t -52.65 -27.93 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 C-N-CA 124.679 1.191 . . . . 44.97 112.753 166.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' SER . . . . . . . . . . . . . 82.0 p -59.18 -22.4 60.92 Favored 'General case' 0 C--O 1.176 -2.812 0 CA-C-N 120.347 1.43 . . . . 45.61 112.743 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -71.34 -15.32 62.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 121.907 2.14 . . . . 64.78 111.673 170.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' LEU . . . . . . . . . . . . . 57.0 mt -98.38 156.37 16.77 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 125.392 1.477 . . . . 48.71 110.517 177.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -129.48 147.81 51.33 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-O 117.76 -1.114 . . . . 110.18 108.66 171.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -51.33 138.14 21.79 Favored 'General case' 0 N--CA 1.512 2.635 0 C-N-CA 125.563 1.545 . . . . 92.82 107.955 169.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 55.25 27.8 47.85 Favored Glycine 1 C--O 1.317 5.31 0 C-N-CA 126.706 2.098 . . . . 62.42 115.619 177.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' GLU . . . . . . . . . . . . 0.268 20.1 tp10 -100.24 149.47 23.54 Favored 'General case' 0 N--CA 1.507 2.398 0 N-CA-C 106.375 -1.713 . . . . 72.97 106.375 162.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -97.13 127.91 43.54 Favored 'General case' 0 C--O 1.291 3.259 0 O-C-N 119.896 -1.752 . . . . 49.06 110.697 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -120.95 147.77 45.01 Favored 'General case' 0 C--O 1.284 2.895 0 N-CA-C 105.958 -1.867 . . . . 37.57 105.958 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' MET . . . . . . . . . . . . . 68.4 mmm -127.31 147.13 50.25 Favored 'General case' 0 C--O 1.278 2.571 0 N-CA-C 104.535 -2.395 . . . . 61.95 104.535 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' PHE . . . . . . . . . . . . . 31.4 p90 -114.13 149.42 35.66 Favored 'General case' 0 C--O 1.182 -2.451 0 N-CA-C 103.803 -2.666 . . . . 45.24 103.803 169.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' PHE . . . . . . . . . . . . . 12.6 p90 -162.83 157.02 20.86 Favored 'General case' 0 C--O 1.3 3.742 0 CA-C-O 127.909 3.718 . . . . 38.64 107.195 -175.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' CYS . . . . . . . . . . . . . 43.5 t -84.12 134.97 34.57 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 112.26 -2.246 . . . . 53.66 108.509 162.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' THR . . . . . . . . . . . . . 57.6 p -104.13 9.89 36.09 Favored 'General case' 0 C--O 1.289 3.183 0 CA-C-N 120.255 1.389 . . . . 43.3 109.53 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -56.01 136.15 73.63 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 106.742 -1.577 . . . . 50.39 106.742 168.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -55.46 116.64 3.29 Favored 'Trans proline' 0 C--O 1.294 3.29 0 C-N-CA 123.383 2.722 . . . . 55.38 115.109 -170.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' GLY . . . . . . . . . . . . . . . 81.82 6.53 88.93 Favored Glycine 0 C--N 1.356 1.69 1 O-C-N 129.863 4.477 . . . . 65.84 110.548 173.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -78.1 -24.61 47.48 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.692 1.246 . . . . 63.44 108.164 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' SER . . . . . . . . . . . . . 14.2 p -68.77 -18.97 64.3 Favored 'General case' 0 C--O 1.254 1.335 0 CA-C-O 117.824 -1.084 . . . . 63.95 109.911 -170.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.9 -48.03 72.84 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 105.831 -1.914 . . . . 69.86 105.831 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' LEU . . . . . 0.449 ' N ' HD23 ' C' ' 120' ' ' LEU . 2.8 mt -85.42 -45.38 11.91 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 116.43 -1.748 . . . . 95.86 111.07 177.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' MET . . . . . . . . . . . . . 55.1 mtp -97.53 82.88 3.15 Favored 'General case' 0 C--O 1.284 2.914 0 N-CA-C 105.963 -1.865 . . . . 70.47 105.963 -159.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.01 171.54 16.68 Favored 'General case' 0 C--O 1.201 -1.477 0 N-CA-C 106.087 -1.82 . . . . 72.81 106.087 174.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' GLY . . . . . . . . . . . . . . . -175.34 -172.57 40.34 Favored Glycine 0 C--N 1.289 -2.064 0 N-CA-C 108.99 -1.644 . . . . 46.9 108.99 168.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' THR . . . . . . . . . . . . . 23.9 p -101.09 150.48 22.87 Favored 'General case' 0 C--O 1.282 2.79 0 C-N-CA 125.533 1.533 . . . . 44.8 107.843 -172.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 tt -133.98 125.1 27.46 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 104.168 -2.53 . . . . 47.88 104.168 171.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' THR . . . . . . . . . . . . . 6.4 m -124.02 136.76 54.49 Favored 'General case' 1 C--O 1.312 4.371 0 CA-C-O 117.346 -1.311 . . . . 54.39 110.961 -178.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' C' ' 127' ' ' LEU . 0.0 OUTLIER -82.98 104.05 12.89 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 114.238 -2.791 . . . . 54.7 109.175 165.561 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.899 0 O-C-N 127.155 2.785 . . . . 92.56 111.039 -172.862 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 N-CA-C 107.297 -1.371 . . . . 110.22 107.297 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' CYS . . . . . . . . . . . . . 60.4 m 63.31 30.56 15.63 Favored 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 124.91 1.284 . . . . 106.13 113.983 160.272 -55.717 -69.604 -88.108 103.311 2.054 104.163 -78.661 -62.31 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' SER . . . . . . . . . . . . . 19.3 p -138.25 169.3 18.03 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 119.142 0.883 . . . . 84.79 111.732 168.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.23 144.55 18.13 Favored 'Isoleucine or valine' 1 C--O 1.327 5.145 0 N-CA-C 107.408 -1.33 . . . . 65.13 107.408 167.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -100.82 122.07 42.78 Favored 'General case' 0 C--O 1.193 -1.898 0 N-CA-C 107.344 -1.354 . . . . 79.91 107.344 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ILE . . . . . 0.539 HD11 HD11 ' D' ' 20' ' ' ILE . 55.2 mt -122.87 156.56 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.597 0 CA-C-O 122.683 1.23 . . . . 66.18 108.796 175.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' GLN . . . . . 0.47 ' OE1' ' HG3' ' D' ' 36' ' ' PRO 0.286 43.8 mt-30 -129.54 146.39 51.37 Favored 'General case' 1 C--O 1.345 6.089 0 C-N-CA 129.79 3.236 . . . . 74.16 109.121 175.577 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.94 131.45 7.77 Favored Glycine 0 C--O 1.267 2.218 0 CA-C-N 110.308 -3.133 . . . . 56.9 108.379 170.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ASN . . . . . . . . . . . . . 56.6 p30 -112.39 -172.46 2.05 Favored 'General case' 0 C--O 1.288 3.104 0 O-C-N 124.696 0.88 . . . . 62.28 108.819 -173.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ASP . . . . . 0.466 ' HA ' ' HG2' ' D' ' 44' ' ' MET . 91.0 m-20 -70.77 -12.51 61.6 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 129.075 2.95 . . . . 80.89 111.728 176.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -103.34 16.74 25.75 Favored 'General case' 0 C--O 1.277 2.52 0 CA-C-O 116.268 -1.825 . . . . 77.87 110.411 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' MET . . . . . . . . . . . . . 36.0 ttm 58.71 42.75 19.75 Favored 'General case' 0 N--CA 1.508 2.459 0 CA-C-N 119.837 1.198 . . . . 60.84 111.231 175.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -120.43 133.71 55.38 Favored 'General case' 1 C--O 1.305 4.009 0 C-N-CA 126.496 1.918 . . . . 70.47 109.304 175.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -83.46 161.56 21.25 Favored 'General case' 0 C--O 1.172 -3.026 0 CA-C-O 117.083 -1.437 . . . . 53.87 107.773 158.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -89.88 10.21 24.66 Favored 'General case' 0 N--CA 1.524 3.231 0 N-CA-C 106.165 -1.791 . . . . 61.23 106.165 -174.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' THR . . . . . . . . . . . . . 1.7 t -165.12 156.77 15.0 Favored 'General case' 1 C--O 1.382 8.064 0 N-CA-C 104.62 -2.363 . . . . 58.31 104.62 -175.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -133.29 15.16 4.14 Favored 'General case' 0 C--O 1.255 1.369 0 C-N-CA 126.115 1.766 . . . . 88.5 108.934 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -154.65 131.66 10.92 Favored 'General case' 0 C--O 1.183 -2.42 0 CA-C-O 115.192 -2.337 . . . . 59.89 112.764 174.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ILE . . . . . 0.539 HD11 HD11 ' D' ' 7' ' ' ILE . 60.0 mt -125.67 131.71 71.7 Favored 'Isoleucine or valine' 0 C--O 1.303 3.91 0 C-N-CA 126.046 1.739 . . . . 57.84 107.688 -178.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' THR . . . . . . . . . . . . . 70.4 p -117.01 129.43 56.02 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 125.78 1.925 . . . . 73.68 106.57 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' VAL . . . . . . . . . . . . . 93.1 t -118.92 106.74 20.03 Favored 'Isoleucine or valine' 0 C--O 1.304 3.957 0 N-CA-C 103.492 -2.781 . . . . 59.15 103.492 -173.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.92 126.62 18.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 127.427 2.955 . . . . 98.56 110.814 169.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -15.48 59.74 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.443 1.897 . . . . 105.95 110.349 -178.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' SER . . . . . . . . . . . . . 85.4 p -80.37 -22.34 41.44 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.842 1.657 . . . . 102.97 109.868 177.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' CYS . . . . . 0.456 ' O ' ' O ' ' D' ' 301' ' ' HOH . 71.4 m -62.76 132.82 53.5 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-N 119.996 1.271 . . . . 99.86 108.437 172.458 -62.31 -78.661 -88.108 104.163 2.054 103.311 -69.604 -55.717 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 -31.35 18.75 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 117.022 -1.466 . . . . 100.74 108.778 173.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mp0 -128.69 146.17 50.96 Favored 'General case' 0 C--O 1.256 1.406 0 C-N-CA 124.426 1.09 . . . . 57.79 110.874 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' PHE . . . . . 0.485 ' O ' ' HA ' ' D' ' 96' ' ' THR . 81.0 t80 -123.81 142.63 50.93 Favored 'General case' 0 C--O 1.263 1.764 0 CA-C-N 121.919 2.145 . . . . 57.98 107.711 178.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 13.8 m -117.87 134.36 55.01 Favored 'General case' 1 C--O 1.131 -5.173 0 N-CA-C 115.374 1.62 . . . . 58.88 115.374 -179.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -117.49 131.35 70.47 Favored 'Isoleucine or valine' 0 C--O 1.273 2.298 0 N-CA-C 106.855 -1.535 . . . . 55.23 106.855 173.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -113.15 110.53 20.58 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 105.219 -2.141 . . . . 57.71 105.219 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' LEU . . . . . . . . . . . . . 11.6 tp -104.82 143.53 33.01 Favored 'General case' 1 C--O 1.309 4.189 0 O-C-N 120.313 -1.492 . . . . 61.47 108.67 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' SER . . . . . . . . . . . . . 53.4 p -147.74 157.52 43.58 Favored 'General case' 0 C--O 1.266 1.966 0 C-N-CA 125.295 1.438 . . . . 73.95 109.355 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -116.34 96.14 47.02 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 128.151 2.581 . . . . 74.18 111.277 -177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' PRO . . . . . 0.585 ' O ' ' O ' ' D' ' 37' ' ' GLY . 18.8 Cg_endo -63.45 -170.93 0.12 Allowed 'Trans proline' 0 C--O 1.182 -2.293 0 C-N-CA 122.577 2.184 . . . . 94.41 114.369 155.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' D' ' 36' ' ' PRO . . . 56.15 160.23 0.01 OUTLIER Glycine 0 C--O 1.282 3.104 0 O-C-N 118.733 -2.48 . . . . 104.01 111.37 178.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -99.36 6.72 46.02 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 127.419 2.287 . . . . 101.87 110.901 -153.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 23.7 mt -94.64 141.51 23.5 Favored Pre-proline 0 C--O 1.213 -0.853 0 C-N-CA 117.015 -1.874 . . . . 99.25 107.91 -166.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -79.4 163.88 24.33 Favored 'Trans proline' 0 C--O 1.199 -1.469 0 C-N-CA 122.796 2.331 . . . . 97.85 117.367 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -53.87 -41.6 67.7 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 127.106 2.163 . . . . 91.73 111.689 -167.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' ASN . . . . . 0.498 ' HA ' HD13 ' D' ' 68' ' ' LEU . 17.0 p-10 -75.71 -12.59 60.22 Favored 'General case' 0 C--O 1.297 3.554 0 CA-C-N 121.668 2.031 . . . . 80.16 108.843 -172.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' VAL . . . . . . . . . . . . . 2.2 t -108.2 -44.82 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 114.75 -2.548 . . . . 71.68 108.127 -173.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' D' ' 11' ' ' ASP . 28.5 tpp -134.35 41.13 2.96 Favored 'General case' 0 C--O 1.28 2.665 0 O-C-N 126.034 2.084 . . . . 71.39 109.987 -175.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.45 136.77 46.35 Favored Glycine 0 C--O 1.264 2.031 0 CA-C-N 117.819 0.281 . . . . 56.46 113.702 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -127.61 149.04 50.36 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-O 118.293 -0.861 . . . . 48.83 109.802 172.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -138.27 177.37 7.93 Favored 'General case' 0 C--O 1.277 2.54 0 N-CA-C 105.679 -1.971 . . . . 35.11 105.679 160.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' TRP . . . . . . . . . . . . 0.278 67.6 t90 -126.75 120.3 29.03 Favored 'General case' 0 C--O 1.175 -2.828 0 N-CA-C 103.346 -2.835 . . . . 31.13 103.346 174.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' D' ' 110' ' ' PHE . 52.0 t -132.86 129.42 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 N-CA-C 104.888 -2.264 . . . . 24.57 104.888 -173.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' LEU . . . . . . . . . . . . . 25.0 tp -100.29 131.72 46.07 Favored 'General case' 0 C--N 1.281 -2.371 0 C-N-CA 129.45 3.1 . . . . 25.9 108.578 170.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' SER . . . . . . . . . . . . . 60.5 p -145.61 174.75 10.91 Favored 'General case' 0 C--N 1.312 -1.034 0 O-C-N 125.973 2.045 . . . . 38.76 108.334 159.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' THR . . . . . . . . . . . . . 63.9 p -56.6 153.77 9.8 Favored 'General case' 1 C--O 1.314 4.453 0 C-N-CA 119.786 -0.766 . . . . 53.33 109.397 163.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.1 -38.92 54.63 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 117.807 -1.092 . . . . 61.52 112.501 163.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.25 -45.06 92.22 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.512 1.125 . . . . 63.26 111.85 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -85.7 -10.73 55.2 Favored 'General case' 0 C--O 1.264 1.845 0 C-N-CA 126.407 1.883 . . . . 73.02 115.299 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' MET . . . . . . . . . . . . . 22.5 ttt -54.96 -50.25 69.37 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 116.97 -1.49 . . . . 49.29 110.876 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 -34.89 79.26 Favored 'General case' 0 N--CA 1.507 2.394 0 CA-C-N 122.763 2.528 . . . . 70.98 110.236 -171.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' GLY . . . . . 0.695 ' HA3' ' NH2' ' D' ' 79' ' ' ARG . . . -64.99 -45.72 91.45 Favored Glycine 0 C--O 1.277 2.833 0 CA-C-N 121.778 2.081 . . . . 47.58 113.08 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' VAL . . . . . . . . . . . . . 82.3 t -54.18 -47.13 67.79 Favored 'Isoleucine or valine' 0 C--O 1.255 1.39 0 CA-C-O 116.488 -1.72 . . . . 39.97 107.773 173.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 37.7 t -71.03 -47.99 58.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 118.015 -1.474 . . . . 40.63 107.673 -171.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' THR . . . . . . . . . . . . 0.261 27.6 p -72.1 -41.86 66.78 Favored 'General case' 0 C--O 1.184 -2.362 0 CA-C-O 115.841 -2.028 . . . . 54.91 107.523 -170.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -57.55 -36.06 71.14 Favored 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 121.915 2.143 . . . . 64.04 112.664 166.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.35 -31.87 40.4 Favored Glycine 0 C--O 1.182 -3.148 1 C-N-CA 112.803 -4.523 . . . . 61.13 109.919 -174.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' MET . . . . . . . . . . . . . 1.3 ttm -60.67 -40.56 92.54 Favored 'General case' 0 C--O 1.199 -1.587 0 CA-C-N 121.276 2.538 . . . . 107.47 108.683 174.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.61 -29.15 69.04 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 116.623 -1.656 . . . . 94.77 110.118 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' SER . . . . . . . . . . . . . 4.6 m -84.41 -24.31 29.67 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 120.973 1.715 . . . . 100.57 112.345 -175.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.13 170.85 46.22 Favored Glycine 0 C--O 1.178 -3.378 0 CA-C-O 117.778 -1.568 . . . . 79.81 112.246 163.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' D' ' 42' ' ' ASN . 21.5 tp -57.29 -35.34 69.68 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 128.136 2.574 . . . . 96.96 109.794 -177.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -46.47 -48.64 19.02 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 126.141 2.151 . . . . 102.88 108.161 178.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 33.79 4.0 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 128.054 2.542 . . . . 117.11 111.749 -175.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 62.91 23.7 14.14 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-N 119.542 1.065 . . . . 106.07 111.797 168.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 49.15 38.1 12.37 Favored 'General case' 0 C--O 1.198 -1.64 0 C-N-CA 124.781 1.232 . . . . 66.55 112.032 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' LEU . . . . . . . . . . . . . 21.4 mt -132.64 136.9 46.78 Favored 'General case' 0 C--O 1.268 2.046 0 C-N-CA 125.31 1.444 . . . . 55.67 109.06 166.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' LYS . . . . . 0.446 ' HB3' ' HB2' ' D' ' 77' ' ' ASP . 25.0 ttpt -50.54 127.47 24.39 Favored Pre-proline 0 C--N 1.317 -0.807 0 O-C-N 125.213 1.571 . . . . 83.9 107.874 162.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -50.38 128.99 24.7 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.626 2.217 . . . . 74.87 112.559 162.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 56.98 19.38 4.57 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 116.534 -1.698 . . . . 93.68 114.287 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' ASP . . . . . 0.446 ' HB2' ' HB3' ' D' ' 74' ' ' LYS . 23.1 t0 -40.34 110.06 0.14 Allowed 'General case' 0 C--O 1.286 3.018 0 CA-C-N 120.863 1.665 . . . . 66.99 107.454 161.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' SER . . . . . . . . . . . . . 2.6 p -63.6 -21.17 66.21 Favored 'General case' 0 C--O 1.196 -1.72 0 C-N-CA 127.845 2.458 . . . . 55.74 112.642 172.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ARG . . . . . 0.695 ' NH2' ' HA3' ' D' ' 58' ' ' GLY . 86.2 mtm180 -80.07 -13.52 59.23 Favored 'General case' 0 C--O 1.17 -3.08 0 CA-C-N 120.793 1.633 . . . . 60.19 108.608 -178.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' VAL . . . . . . . . . . . . . 93.1 t -82.32 109.4 16.29 Favored 'Isoleucine or valine' 0 C--O 1.179 -2.657 0 N-CA-C 107.577 -1.268 . . . . 38.48 107.577 -173.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' ILE . . . . . . . . . . . . . 50.0 mt -76.75 -37.36 28.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.92 0 C-N-CA 112.962 -3.495 . . . . 41.28 105.747 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' ALA . . . . . . . . . . . . . . . -159.68 147.67 17.19 Favored 'General case' 0 N--CA 1.516 2.845 0 CA-C-N 121.481 1.946 . . . . 28.19 108.371 -176.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -153.4 158.23 41.15 Favored 'General case' 0 C--N 1.288 -2.102 0 CA-C-N 121.246 1.839 . . . . 38.87 113.576 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 3.0 p -86.23 173.3 9.87 Favored 'General case' 0 C--O 1.277 2.507 0 C-N-CA 124.638 1.175 . . . . 45.8 112.909 160.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' LYS . . . . . . . . . . . . . 3.2 mttp -74.16 154.17 39.21 Favored 'General case' 1 C--O 1.339 5.791 0 CA-C-N 112.705 -2.043 . . . . 97.5 106.134 171.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' LEU . . . . . . . . . . . . . 13.1 tp -76.5 135.77 39.33 Favored 'General case' 1 C--O 1.317 4.634 0 O-C-N 128.626 3.704 . . . . 62.35 106.765 171.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' ILE . . . . . . . . . . . . . 18.9 pt -132.66 146.45 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 107.06 -1.459 . . . . 60.14 107.06 -169.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' GLY . . . . . . . . . . . . . . . -113.07 -174.17 19.02 Favored Glycine 0 CA--C 1.56 2.847 0 C-N-CA 120.382 -0.913 . . . . 62.53 113.416 156.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' SER . . . . . . . . . . . . . 3.6 t -28.76 128.5 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 128.599 2.76 . . . . 81.85 111.843 -175.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 71.7 8.84 68.63 Favored Glycine 0 C--O 1.2 -1.997 0 CA-C-O 117.022 -1.988 . . . . 87.11 112.956 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -96.49 176.3 6.08 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 121.121 2.46 . . . . 95.57 110.565 176.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.01 160.44 41.07 Favored 'General case' 0 C--O 1.202 -1.408 0 O-C-N 124.908 1.38 . . . . 91.08 109.985 172.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -168.58 160.26 10.73 Favored 'General case' 0 C--O 1.165 -3.37 0 O-C-N 124.3 1.0 . . . . 92.81 108.661 -178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' SER . . . . . . . . . . . . . 1.1 t -149.04 139.86 22.79 Favored 'General case' 1 C--O 1.32 4.815 0 CA-C-O 113.938 -2.934 . . . . 85.7 108.639 -157.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 8.4 p -142.1 141.95 28.28 Favored 'Isoleucine or valine' 0 C--O 1.163 -3.456 1 O-C-N 129.356 4.16 . . . . 45.98 108.142 176.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' D' ' 29' ' ' PHE . 85.2 m -124.45 146.82 48.7 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 104.313 -2.477 . . . . 52.15 104.313 174.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -148.35 159.27 44.17 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 104.686 -2.339 . . . . 42.51 104.686 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -77.46 125.8 29.9 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 127.691 3.12 . . . . 76.53 108.42 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' VAL . . . . . . . . . . . . . 73.7 t -68.69 -24.77 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 126.213 1.805 . . . . 59.81 108.189 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' SER . . . . . . . . . . . . . 29.6 p -55.51 -28.08 52.51 Favored 'General case' 0 C--O 1.192 -1.941 0 CA-C-O 116.733 -1.603 . . . . 64.94 112.005 171.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 mtpt -67.71 -18.04 64.78 Favored 'General case' 0 C--O 1.156 -3.818 0 CA-C-O 115.947 -1.978 . . . . 60.11 109.726 176.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' LEU . . . . . . . . . . . . . 36.3 mt -98.53 152.1 19.92 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.307 1.443 . . . . 65.21 109.905 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' LYS . . . . . . . . . . . . . 18.1 mtpt -131.4 142.59 50.07 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.15 -1.056 . . . . 107.61 108.15 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -47.36 144.21 3.04 Favored 'General case' 0 C--O 1.295 3.463 0 C-N-CA 126.221 1.808 . . . . 117.69 110.539 167.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.78 -6.65 6.12 Favored Glycine 1 C--O 1.302 4.368 0 CA-C-O 117.913 -1.493 . . . . 82.66 114.986 173.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' GLU . . . . . . . . . . . . 0.263 6.0 tp10 -93.01 141.6 28.21 Favored 'General case' 0 C--O 1.183 -2.44 0 CA-C-N 119.475 1.637 . . . . 83.48 108.098 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' GLN . . . . . 0.694 HE22 HG22 ' D' ' 124' ' ' THR 0.305 0.7 OUTLIER -91.87 122.53 34.48 Favored 'General case' 1 C--O 1.344 6.072 0 CA-C-O 123.956 1.836 . . . . 56.05 106.995 -176.085 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -115.12 143.4 45.28 Favored 'General case' 1 C--O 1.361 6.962 0 N-CA-C 104.444 -2.428 . . . . 51.48 104.444 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' MET . . . . . . . . . . . . . 88.9 mmm -119.03 143.98 46.79 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 104.953 -2.24 . . . . 70.66 104.953 177.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' PHE . . . . . 0.424 ' HA ' ' O ' ' D' ' 49' ' ' VAL 0.278 2.4 p90 -109.57 146.7 34.25 Favored 'General case' 0 C--O 1.158 -3.733 0 N-CA-C 104.831 -2.285 . . . . 35.58 104.831 169.108 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -160.0 162.53 34.32 Favored 'General case' 0 C--O 1.172 -2.975 0 O-C-N 121.741 -0.599 . . . . 26.66 110.006 -175.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' CYS . . . . . . . . . . . . . 2.2 t -98.19 141.59 30.93 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 106.631 -1.618 . . . . 38.05 106.631 166.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' THR . . . . . . . . . . . . . 31.0 p -108.83 19.19 19.93 Favored 'General case' 0 C--O 1.195 -1.799 0 O-C-N 119.684 -1.885 . . . . 31.51 111.418 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -72.36 141.99 83.87 Favored Pre-proline 0 N--CA 1.5 2.056 0 CA-C-O 114.884 -2.484 . . . . 51.63 108.118 165.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -48.58 116.04 1.9 Allowed 'Trans proline' 1 C--O 1.314 4.307 1 C-N-CA 125.982 4.454 . . . . 46.54 115.763 -175.717 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.93 -5.67 81.93 Favored Glycine 1 C--O 1.133 -6.162 1 O-C-N 129.239 4.087 . . . . 43.07 109.336 171.192 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' HIS . . . . . . . . . . . . . 53.6 m170 -83.72 -19.01 35.96 Favored 'General case' 0 C--O 1.273 2.296 0 CA-C-O 116.667 -1.635 . . . . 51.88 109.614 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' SER . . . . . . . . . . . . . 89.2 p -75.62 -16.66 60.19 Favored 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.068 -2.653 . . . . 40.54 111.067 -170.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.44 -51.89 63.75 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 105.692 -1.966 . . . . 52.32 105.692 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' D' ' 120' ' ' LEU . 15.2 mt -83.16 -44.59 14.9 Favored 'General case' 0 C--O 1.265 1.902 0 CA-C-O 113.989 -2.91 . . . . 81.66 112.369 177.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' MET . . . . . . . . . . . . . 53.4 mtp -91.96 73.28 5.61 Favored 'General case' 0 C--N 1.365 1.267 0 O-C-N 126.857 2.598 . . . . 48.72 107.315 -164.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.99 171.95 14.1 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 118.274 -2.766 . . . . 73.97 109.38 173.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' GLY . . . . . . . . . . . . . . . -179.05 -166.83 35.64 Favored Glycine 1 C--O 1.16 -4.485 0 O-C-N 125.74 1.9 . . . . 41.1 111.427 166.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' THR . . . . . 0.694 HG22 HE22 ' D' ' 107' ' ' GLN . 20.9 p -99.95 149.31 23.56 Favored 'General case' 1 C--O 1.317 4.639 0 C-N-CA 128.21 2.604 . . . . 53.93 105.919 -166.235 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' LEU . . . . . . . . . . . . . 2.5 tt -141.0 109.39 5.88 Favored 'General case' 0 C--O 1.288 3.13 0 N-CA-C 103.041 -2.948 . . . . 46.85 103.041 179.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' THR . . . . . . . . . . . . . 4.3 m -120.66 136.17 54.91 Favored 'General case' 0 C--O 1.296 3.526 1 O-C-N 129.159 4.037 . . . . 61.83 112.141 -172.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' D' ' 127' ' ' LEU . 0.1 OUTLIER -81.71 97.33 7.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 127.46 2.975 . . . . 93.41 109.434 174.286 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.368 0 C-N-CA 128.669 2.788 . . . . 122.06 109.573 -171.623 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 301' ' ' HOH . . . . . 0.456 ' O ' ' O ' ' D' ' 26' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_